700-91-4,MFCD06661359
Catalog No.:AA005LHJ

700-91-4 | 5-Phenyl-3,4-dihydro-2H-pyrrole

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$327.00   $229.00
- +
1g
98%
in stock  
$1,024.00   $717.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA005LHJ
Chemical Name:
5-Phenyl-3,4-dihydro-2H-pyrrole
CAS Number:
700-91-4
Molecular Formula:
C10H11N
Molecular Weight:
145.2010
MDL Number:
MFCD06661359
SMILES:
c1ccc(cc1)C1=NCCC1
NSC Number:
94962
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
154  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.7  

Downstream Synthesis Route

[1]JournaloftheAmericanChemicalSociety,2006,vol.128,p.2224-2225

[2]TetrahedronLetters,1997,vol.38,p.7487-7490

[3]Patent:US5292893,1994,A

[4]JournalofOrganicChemistry,1997,vol.62,p.7726-7735

[5]Chemistry-AEuropeanJournal,2019,vol.25,p.1918-1922

[6]YakugakuZasshi/JournalofthePharmaceuticalSocietyofJapan,1957,vol.77,p.1062    Chem.Abstr.,1958,p.5376

[7]JournalofOrganicChemistry,1980,vol.45,p.2489-2498

[8]BioorganicandMedicinalChemistry,2001,vol.9,p.2105-2111

[9]JournalofCatalysis,2004,vol.224,p.170-177

[10]JournaloftheAmericanChemicalSociety,2002,vol.124,p.3220-3221

[11]AdvancedSynthesisandCatalysis,2004,vol.346,p.1316-1328

[12]Patent:WO2005/56513,2005,A1.Locationinpatent:Page/Pagecolumn30

[13]Patent:WO2005/56513,2005,A1.Locationinpatent:Page/Pagecolumn30

[14]Patent:WO2005/56513,2005,A1.Locationinpatent:Page/Pagecolumn30

[15]Patent:WO2005/56513,2005,A1.Locationinpatent:Page/Pagecolumn30

[16]AngewandteChemie-InternationalEdition,2018,vol.57,p.1863-1868    Angew.Chem.,2018,vol.130,p.1881-1886,6

[17]Tetrahedron,2018,vol.74,p.3947-3954

[18]JournaloftheAmericanChemicalSociety,2018,vol.140,p.13171-13175

[19]JournaloftheAmericanChemicalSociety,2019,vol.141,p.15869-15878

[20]Bioorganicandmedicinalchemistryletters,2020,vol.30

[1]JournaloftheAmericanChemicalSociety,1999,vol.121,p.1524-1527

[2]OrganicandBiomolecularChemistry,2017,vol.15,p.3006-3012

[3]AdvancedSynthesisandCatalysis,2021,vol.363,p.1317-1321

[4]JournalofOrganicChemistry,1993,vol.58,p.7627-7629

[5]JournaloftheAmericanChemicalSociety,1994,vol.116,p.8952-8965

[6]JournaloftheAmericanChemicalSociety,1994,vol.116,p.11703-11714

[7]JournaloftheAmericanChemicalSociety,1994,vol.116,p.11703-11714

[8]JournaloftheAmericanChemicalSociety,1994,vol.116,p.8952-8965

[9]JournaloftheAmericanChemicalSociety,1992,vol.114,p.7562-7564

[10]JournaloftheAmericanChemicalSociety,1992,vol.114,p.7562-7564

[11]JournaloftheAmericanChemicalSociety,2006,vol.128,p.2224-2225

[12]ChemCatChem,2018,vol.10,p.3236-3246

[13]JournaloftheAmericanChemicalSociety,2019,vol.141,p.15869-15878

[1]JournalofOrganicChemistry,1989,vol.54,p.228-234

[2]OrganicLetters,2017,vol.19,p.4215-4218

[3]Patent:WO2019/210828,2019,A1.Locationinpatent:Paragraph0242;0243

[1]JournaloftheAmericanChemicalSociety,1996,vol.118,p.6784-6785

[2]ACSCatalysis,2016,vol.6,p.3880-3889

[3]ChemCatChem,2018,vol.10,p.3236-3246

[1]Singh,PradeepN.D.;Klima,RodneyF.;Muthukrishnan,Sivaramakrishnan;Murthy,RajeshS.;Sankaranarayanan,Jagadis;Stahlecker,HeidiM.;Patel,Bhavika;Gudmundsdóttir,AnnaD.[TetrahedronLetters,2005,vol.46,#24,p.4213-4217]

[2]Dickerson,TobinJ.;Janda,KimD.[JournaloftheAmericanChemicalSociety,2002,vol.124,#13,p.3220-3221]

[3]DeKimpe,Norbert;Tehrani,KouroschAbbaspour;Stevens,Christian;DeCooman,Paul[Tetrahedron,1997,vol.53,#10,p.3693-3706]

[4]Wills,MaxT.;Wills,IreneE.;Dollen,LawrenceVon;Butler,BarryL.;Porter,John;Anderson,ArthurG.[JournalofOrganicChemistry,1980,vol.45,#12,p.2489-2498]

[5]Huang,Fei;Zhang,Songlin[OrganicLetters,2019,vol.21,#18,p.7430-7434]

[6]Wang,Yiqiong;Huang,Fei;Zhang,Songlin[EuropeanJournalofOrganicChemistry,2020,vol.2020,#32,p.5178-5181]

Literature

Title: Tethered ansa-bridged titanium complexes immobilized on 3-mercaptopropyl-functionalized silica gel and their application for the hydrosilylation of imines.

Journal: Dalton transactions (Cambridge, England : 2003) 20121107

Title: 5-phenyl-3,4-dihydro-2H-pyrrole: the first example of a planar monosubstituted 1-pyrroline.

Journal: Acta crystallographica. Section C, Crystal structure communications 20080601

Quotation Request
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Additional Info:
SDS
Tags:700-91-4 Molecular Formula|700-91-4 MDL|700-91-4 SMILES|700-91-4 5-Phenyl-3,4-dihydro-2H-pyrrole
Catalog No.: AA005LHJ
700-91-4,MFCD06661359
700-91-4 | 5-Phenyl-3,4-dihydro-2H-pyrrole
Pack Size: 250mg
Purity: 98%
in stock
$327.00 $229.00
Pack Size: 1g
Purity: 98%
in stock
$1,024.00 $717.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA005LHJ
Chemical Name: 5-Phenyl-3,4-dihydro-2H-pyrrole
CAS Number: 700-91-4
Molecular Formula: C10H11N
Molecular Weight: 145.2010
MDL Number: MFCD06661359
SMILES: c1ccc(cc1)C1=NCCC1
NSC Number: 94962
Properties
Storage: Keep in dry area;2-8℃;  
Complexity: 154  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.7  
Downstream Synthesis Route
700-91-4    1006-64-0 

[1]JournaloftheAmericanChemicalSociety,2006,vol.128,p.2224-2225

[2]TetrahedronLetters,1997,vol.38,p.7487-7490

[3]Patent:US5292893,1994,A

[4]JournalofOrganicChemistry,1997,vol.62,p.7726-7735

[5]Chemistry-AEuropeanJournal,2019,vol.25,p.1918-1922

[6]YakugakuZasshi/JournalofthePharmaceuticalSocietyofJapan,1957,vol.77,p.1062    Chem.Abstr.,1958,p.5376

[7]JournalofOrganicChemistry,1980,vol.45,p.2489-2498

[8]BioorganicandMedicinalChemistry,2001,vol.9,p.2105-2111

[9]JournalofCatalysis,2004,vol.224,p.170-177

[10]JournaloftheAmericanChemicalSociety,2002,vol.124,p.3220-3221

[11]AdvancedSynthesisandCatalysis,2004,vol.346,p.1316-1328

[12]Patent:WO2005/56513,2005,A1.Locationinpatent:Page/Pagecolumn30

[13]Patent:WO2005/56513,2005,A1.Locationinpatent:Page/Pagecolumn30

[14]Patent:WO2005/56513,2005,A1.Locationinpatent:Page/Pagecolumn30

[15]Patent:WO2005/56513,2005,A1.Locationinpatent:Page/Pagecolumn30

[16]AngewandteChemie-InternationalEdition,2018,vol.57,p.1863-1868    Angew.Chem.,2018,vol.130,p.1881-1886,6

[17]Tetrahedron,2018,vol.74,p.3947-3954

[18]JournaloftheAmericanChemicalSociety,2018,vol.140,p.13171-13175

[19]JournaloftheAmericanChemicalSociety,2019,vol.141,p.15869-15878

[20]Bioorganicandmedicinalchemistryletters,2020,vol.30

700-91-4    56523-47-8 

[1]JournaloftheAmericanChemicalSociety,1999,vol.121,p.1524-1527

[2]OrganicandBiomolecularChemistry,2017,vol.15,p.3006-3012

[3]AdvancedSynthesisandCatalysis,2021,vol.363,p.1317-1321

[4]JournalofOrganicChemistry,1993,vol.58,p.7627-7629

[5]JournaloftheAmericanChemicalSociety,1994,vol.116,p.8952-8965

[6]JournaloftheAmericanChemicalSociety,1994,vol.116,p.11703-11714

[7]JournaloftheAmericanChemicalSociety,1994,vol.116,p.11703-11714

[8]JournaloftheAmericanChemicalSociety,1994,vol.116,p.8952-8965

[9]JournaloftheAmericanChemicalSociety,1992,vol.114,p.7562-7564

[10]JournaloftheAmericanChemicalSociety,1992,vol.114,p.7562-7564

[11]JournaloftheAmericanChemicalSociety,2006,vol.128,p.2224-2225

[12]ChemCatChem,2018,vol.10,p.3236-3246

[13]JournaloftheAmericanChemicalSociety,2019,vol.141,p.15869-15878

116437-41-3    700-91-4 

[1]JournalofOrganicChemistry,1989,vol.54,p.228-234

[2]OrganicLetters,2017,vol.19,p.4215-4218

[3]Patent:WO2019/210828,2019,A1.Locationinpatent:Paragraph0242;0243

700-91-4    1006-64-0 

[1]JournaloftheAmericanChemicalSociety,1996,vol.118,p.6784-6785

[2]ACSCatalysis,2016,vol.6,p.3880-3889

[3]ChemCatChem,2018,vol.10,p.3236-3246

939-52-6    700-91-4 

[1]Singh,PradeepN.D.;Klima,RodneyF.;Muthukrishnan,Sivaramakrishnan;Murthy,RajeshS.;Sankaranarayanan,Jagadis;Stahlecker,HeidiM.;Patel,Bhavika;Gudmundsdóttir,AnnaD.[TetrahedronLetters,2005,vol.46,#24,p.4213-4217]

[2]Dickerson,TobinJ.;Janda,KimD.[JournaloftheAmericanChemicalSociety,2002,vol.124,#13,p.3220-3221]

[3]DeKimpe,Norbert;Tehrani,KouroschAbbaspour;Stevens,Christian;DeCooman,Paul[Tetrahedron,1997,vol.53,#10,p.3693-3706]

[4]Wills,MaxT.;Wills,IreneE.;Dollen,LawrenceVon;Butler,BarryL.;Porter,John;Anderson,ArthurG.[JournalofOrganicChemistry,1980,vol.45,#12,p.2489-2498]

[5]Huang,Fei;Zhang,Songlin[OrganicLetters,2019,vol.21,#18,p.7430-7434]

[6]Wang,Yiqiong;Huang,Fei;Zhang,Songlin[EuropeanJournalofOrganicChemistry,2020,vol.2020,#32,p.5178-5181]

Literature fold

Title: Tethered ansa-bridged titanium complexes immobilized on 3-mercaptopropyl-functionalized silica gel and their application for the hydrosilylation of imines.

Journal: Dalton transactions (Cambridge, England : 2003)20121107

Title: 5-phenyl-3,4-dihydro-2H-pyrrole: the first example of a planar monosubstituted 1-pyrroline.

Journal: Acta crystallographica. Section C, Crystal structure communications20080601

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