1746-13-0,MFCD00008644
Catalog No.:AA001ZQB

1746-13-0 | Allyl phenyl ether

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1g
98%(GC)
in stock  
$24.00   $17.00
- +
5g
98%
in stock  
$27.00   $19.00
- +
25g
98%
in stock  
$37.00   $26.00
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100g
98%
in stock  
$107.00   $75.00
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500g
98%
in stock  
$456.00 $319.00
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA001ZQB
Chemical Name:
Allyl phenyl ether
CAS Number:
1746-13-0
Molecular Formula:
C9H10O
Molecular Weight:
134.1751
MDL Number:
MFCD00008644
SMILES:
C=CCOc1ccccc1
NSC Number:
4746
Properties
Properties
 
BP:
191.7°C  
Form:
Liquid  
Refractive Index:
n20/D 1.522(lit.)  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
92.9  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.9  

Upstream Synthesis Route

[1]Synthesis(Germany),2017,vol.49,#18,p.4254-4260

[1]Synthesis(Germany),2017,vol.49,#18,p.4254-4260

[1]OrganicandBiomolecularChemistry,2016,vol.14,#24,p.5622-5626

[1]IndianJournalofChemistry,SectionB:OrganicChemistryIncludingMedicinalChemistry,1978,vol.16,p.430-431

[1]JournalofOrganometallicChemistry,1995,vol.492,#1,p.31-34

Downstream Synthesis Route

[1]Monguchi,Yasunari;Wakayama,Fumika;Takada,Hitoshi;Sawama,Yoshinari;Sajiki,Hironao[Synlett,2015,vol.26,#5,p.700-704]

[2]Jonsson;Faernegardh;Baeckvall[JournaloftheAmericanChemicalSociety,2001,vol.123,#7,p.1365-1371]

[3]Doebler,Christian;Mehltretter,GeraldM.;Sundermeier,Uta;Beller,Matthias[JournaloftheAmericanChemicalSociety,2000,vol.122,#42,p.10289-10289]

[4]Locationinpatent:experimentalpartFujita,Ken-Ichi;Umeki,Satoshi;Yamazaki,Manabu;Ainoya,Taku;Tsuchimoto,Teruhisa;Yasuda,Hiroyuki[TetrahedronLetters,2011,vol.52,#24,p.3137-3140]

[5]Closson,Adam;Johansson,Mikael;Baeckvall,Jan-E.[ChemicalCommunications,2004,#13,p.1494-1495]

[6]Locationinpatent:experimentalpartFujita,Ken-Ichi;Yamazaki,Manabu;Ainoya,Taku;Tsuchimoto,Teruhisa;Yasuda,Hiroyuki[Tetrahedron,2010,vol.66,#44,p.8536-8543]

[7]Fujita,Ken-Ichi;Inoue,Kensuke;Tsuchimoto,Teruhisa;Yasuda,Hiroyuki[ChemicalandPharmaceuticalBulletin,2012,vol.60,#12,p.1594-1598]

[8]CurrentPatentAssignee:DOWINC-US6646102,2003,B2Locationinpatent:Page/Pagecolumn43-44

[9]Johansson,Mikael;Lindén,AuriA.;Bäckvall,Jan-E.[JournalofOrganometallicChemistry,2005,vol.690,#15,p.3614-3619]

[10]Emmanuvel,Lourdusamy;AliShaikh,TanveerMahammad;Sudalai,Arumugam[OrganicLetters,2005,vol.7,#22,p.5071-5074]

[11]Cano,Rafael;Pérez,JuanaM.;Ramón,DiegoJ.[AppliedCatalysisA:General,2014,vol.470,p.177-182]

[12]Wang,Azhong;Jiang,Huanfeng[JournalofOrganicChemistry,2010,vol.75,#7,p.2321-2326]

[13]Ryan;O'Connor[JournaloftheAmericanChemicalSociety,1952,vol.74,p.5866,5868]

[14]Koehler,Valentin;Mao,Jincheng;Heinisch,Tillmann;Pordea,Anca;Sardo,Alessia;Wilson,YvonneM.;Knoerr,Livia;Creus,Marc;Prost,Jean-Christophe;Schirmer,Tilman;Ward,ThomasR.[AngewandteChemie-InternationalEdition,2011,vol.50,#46,p.10863-10866]

[15]Ramírez-Contreras,Rodrigo;Morandi,Bill[OrganicLetters,2016,vol.18,#15,p.3718-3721]

[16]Xia,Qingchun;Li,Zijian;Tan,Chunxia;Liu,Yan;Gong,Wei;Cui,Yong[JournaloftheAmericanChemicalSociety,2017,vol.139,#24,p.8259-8266]

[1]JournaloftheChemicalSociety,1935,p.1365

[1]MonatsheftefurChemie,1951,vol.82,p.588,592

[1]CurrentPatentAssignee:CHANGSHUINSTITUTEOFTECHNOLOGY-CN113683492,2021,ALocationinpatent:Paragraph0057-0077

[2]Mahajan,R.K.;Srivastava,M.M.[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1978,vol.16,p.430-431]

[1]Tetrahedron,2007,vol.63,p.11325-11340

[2]Synthesis,1979,p.202-204

[3]JournalofOrganicChemistry,1990,vol.55,p.5324-5335

[4]MonatsheftefurChemie,1996,vol.127,p.167-172

Literature

Title: Photo-impulsive reactions in the electronic ground state without electronic excitation: non-photo, non-thermal chemical reactions.

Journal: Physical chemistry chemical physics : PCCP 20120721

Title: The phenoxyl radical-water complex--a matrix isolation and computational study.

Journal: Journal of the American Chemical Society 20120516

Title: Pd-catalyzed synthesis of allylic silanes from allylic ethers.

Journal: Organic letters 20100101

Title: Synthesis of unsymmetrical benzil licoagrodione.

Journal: The Journal of organic chemistry 20080919

Title: A theoretical study of pericyclic rearrangements catalyzed by lithium.

Journal: The journal of physical chemistry. A 20080612

Title: Zirconium-mediated coupling reactions of amines and enol or allyl ethers: synthesis of allyl- and homoallylamines.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20040105

Title: SmI2/water/amine mediates cleavage of allyl ether protected alcohols: application in carbohydrate synthesis and mechanistic considerations.

Journal: Organic letters 20031030

Title: Facile allylic C-H bond activation on the bridging disulfide ligand in the Ru(III) dinuclear complex having a conjugated RuSSRu core.

Journal: Inorganic chemistry 20011022

Title: LiCB(11)Me(12): a catalyst for pericyclic rearrangements.

Journal: Organic letters 20010726

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Additional Info:
SDS
Tags:1746-13-0 Molecular Formula|1746-13-0 MDL|1746-13-0 SMILES|1746-13-0 Allyl phenyl ether
Catalog No.: AA001ZQB
1746-13-0,MFCD00008644
1746-13-0 | Allyl phenyl ether
Pack Size: 1g
Purity: 98%(GC)
in stock
$24.00 $17.00
Pack Size: 5g
Purity: 98%
in stock
$27.00 $19.00
Pack Size: 25g
Purity: 98%
in stock
$37.00 $26.00
Pack Size: 100g
Purity: 98%
in stock
$107.00 $75.00
Pack Size: 500g
Purity: 98%
in stock
$456.00 $319.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA001ZQB
Chemical Name: Allyl phenyl ether
CAS Number: 1746-13-0
Molecular Formula: C9H10O
Molecular Weight: 134.1751
MDL Number: MFCD00008644
SMILES: C=CCOc1ccccc1
NSC Number: 4746
Properties
BP: 191.7°C  
Form: Liquid  
Refractive Index: n20/D 1.522(lit.)  
Storage: 2-8℃;  
Complexity: 92.9  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.9  
Upstream Synthesis Route
1746-13-0    1914-60-9 

[1]Synthesis(Germany),2017,vol.49,#18,p.4254-4260

1746-13-0    66158-96-1 

[1]Synthesis(Germany),2017,vol.49,#18,p.4254-4260

1746-13-0    90561-10-7    588-63-6 

[1]OrganicandBiomolecularChemistry,2016,vol.14,#24,p.5622-5626

1746-13-0    588-63-6 

[1]IndianJournalofChemistry,SectionB:OrganicChemistryIncludingMedicinalChemistry,1978,vol.16,p.430-431

67-56-1    1746-13-0    77-76-9 

[1]JournalofOrganometallicChemistry,1995,vol.492,#1,p.31-34

Downstream Synthesis Route
1746-13-0    538-43-2 

[1]Monguchi,Yasunari;Wakayama,Fumika;Takada,Hitoshi;Sawama,Yoshinari;Sajiki,Hironao[Synlett,2015,vol.26,#5,p.700-704]

[2]Jonsson;Faernegardh;Baeckvall[JournaloftheAmericanChemicalSociety,2001,vol.123,#7,p.1365-1371]

[3]Doebler,Christian;Mehltretter,GeraldM.;Sundermeier,Uta;Beller,Matthias[JournaloftheAmericanChemicalSociety,2000,vol.122,#42,p.10289-10289]

[4]Locationinpatent:experimentalpartFujita,Ken-Ichi;Umeki,Satoshi;Yamazaki,Manabu;Ainoya,Taku;Tsuchimoto,Teruhisa;Yasuda,Hiroyuki[TetrahedronLetters,2011,vol.52,#24,p.3137-3140]

[5]Closson,Adam;Johansson,Mikael;Baeckvall,Jan-E.[ChemicalCommunications,2004,#13,p.1494-1495]

[6]Locationinpatent:experimentalpartFujita,Ken-Ichi;Yamazaki,Manabu;Ainoya,Taku;Tsuchimoto,Teruhisa;Yasuda,Hiroyuki[Tetrahedron,2010,vol.66,#44,p.8536-8543]

[7]Fujita,Ken-Ichi;Inoue,Kensuke;Tsuchimoto,Teruhisa;Yasuda,Hiroyuki[ChemicalandPharmaceuticalBulletin,2012,vol.60,#12,p.1594-1598]

[8]CurrentPatentAssignee:DOWINC-US6646102,2003,B2Locationinpatent:Page/Pagecolumn43-44

[9]Johansson,Mikael;Lindén,AuriA.;Bäckvall,Jan-E.[JournalofOrganometallicChemistry,2005,vol.690,#15,p.3614-3619]

[10]Emmanuvel,Lourdusamy;AliShaikh,TanveerMahammad;Sudalai,Arumugam[OrganicLetters,2005,vol.7,#22,p.5071-5074]

[11]Cano,Rafael;Pérez,JuanaM.;Ramón,DiegoJ.[AppliedCatalysisA:General,2014,vol.470,p.177-182]

[12]Wang,Azhong;Jiang,Huanfeng[JournalofOrganicChemistry,2010,vol.75,#7,p.2321-2326]

[13]Ryan;O'Connor[JournaloftheAmericanChemicalSociety,1952,vol.74,p.5866,5868]

[14]Koehler,Valentin;Mao,Jincheng;Heinisch,Tillmann;Pordea,Anca;Sardo,Alessia;Wilson,YvonneM.;Knoerr,Livia;Creus,Marc;Prost,Jean-Christophe;Schirmer,Tilman;Ward,ThomasR.[AngewandteChemie-InternationalEdition,2011,vol.50,#46,p.10863-10866]

[15]Ramírez-Contreras,Rodrigo;Morandi,Bill[OrganicLetters,2016,vol.18,#15,p.3718-3721]

[16]Xia,Qingchun;Li,Zijian;Tan,Chunxia;Liu,Yan;Gong,Wei;Cui,Yong[JournaloftheAmericanChemicalSociety,2017,vol.139,#24,p.8259-8266]

1746-13-0    622-85-5    108-95-2 

[1]JournaloftheChemicalSociety,1935,p.1365

4873-09-0    139-02-6    1746-13-0 

[1]MonatsheftefurChemie,1951,vol.82,p.588,592

1746-13-0    588-63-6 

[1]CurrentPatentAssignee:CHANGSHUINSTITUTEOFTECHNOLOGY-CN113683492,2021,ALocationinpatent:Paragraph0057-0077

[2]Mahajan,R.K.;Srivastava,M.M.[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1978,vol.16,p.430-431]

1746-13-0    2120-70-9 

[1]Tetrahedron,2007,vol.63,p.11325-11340

[2]Synthesis,1979,p.202-204

[3]JournalofOrganicChemistry,1990,vol.55,p.5324-5335

[4]MonatsheftefurChemie,1996,vol.127,p.167-172

Literature fold

Title: Photo-impulsive reactions in the electronic ground state without electronic excitation: non-photo, non-thermal chemical reactions.

Journal: Physical chemistry chemical physics : PCCP20120721

Title: The phenoxyl radical-water complex--a matrix isolation and computational study.

Journal: Journal of the American Chemical Society20120516

Title: Pd-catalyzed synthesis of allylic silanes from allylic ethers.

Journal: Organic letters20100101

Title: Synthesis of unsymmetrical benzil licoagrodione.

Journal: The Journal of organic chemistry20080919

Title: A theoretical study of pericyclic rearrangements catalyzed by lithium.

Journal: The journal of physical chemistry. A20080612

Title: Zirconium-mediated coupling reactions of amines and enol or allyl ethers: synthesis of allyl- and homoallylamines.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany)20040105

Title: SmI2/water/amine mediates cleavage of allyl ether protected alcohols: application in carbohydrate synthesis and mechanistic considerations.

Journal: Organic letters20031030

Title: Facile allylic C-H bond activation on the bridging disulfide ligand in the Ru(III) dinuclear complex having a conjugated RuSSRu core.

Journal: Inorganic chemistry20011022

Title: LiCB(11)Me(12): a catalyst for pericyclic rearrangements.

Journal: Organic letters20010726

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