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3061-36-7,MFCD00038368
Catalog No.:AA0030LQ

3061-36-7 | Benzene, 1,4-diphenoxy-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
95%
in stock  
$27.00   $19.00
- +
25g
95%
in stock  
$64.00   $45.00
- +
100g
95%
in stock  
$186.00 $130.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0030LQ
Chemical Name:
Benzene, 1,4-diphenoxy-
CAS Number:
3061-36-7
Molecular Formula:
C18H14O2
Molecular Weight:
262.3026
MDL Number:
MFCD00038368
SMILES:
c1ccc(cc1)Oc1ccc(cc1)Oc1ccccc1
Properties
Computed Properties
 
Complexity:
231  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
5.7  

Downstream Synthesis Route

[1]Suter;Green[JournaloftheAmericanChemicalSociety,1937,vol.59,p.2578]

[2]Suter;Green[JournaloftheAmericanChemicalSociety,1937,vol.59,p.2578]

79-37-8    3061-36-7   
4,4'-Bis-(4-phenoxy-phenoxy)-benzil 

[1]Arbusow;Achmed-Sade[ZhurnalObshcheiKhimii,1942,vol.12,p.212,216][Chem.Abstr.,1943,p.2733]

[1]Ullmann;Sponagel[ChemischeBerichte,1905,vol.38,p.2212][JustusLiebigsAnnalenderChemie,1906,vol.350,p.103]

[1]Kotera;Go[NipponKagakuKaishi/JournaloftheChemicalSocietyofJapan,1940,vol.61,p.455,458][Chem.Abstr.,1940,p.5712]

[1]Hellwinkel,Dieter;Kistenmacher,Thomas[LiebigsAnnalenderChemie,1989,p.945-950]

[2]Okazaki,Takao;Nakagawa,Madoka;Futemma,Takeshi;Kitagawa,Toshikazu[JournalofPhysicalOrganicChemistry,2016,vol.29,#2,p.107-111]

Literature

Title: Molecular modeling study and synthesis of novel dicationic flexible triaryl guanidines and imidamides as antiprotozoal agents.

Journal: European journal of medicinal chemistry 20111201

Title: Hydroquinone, a benzene metabolite, induces Hog1-dependent stress response signaling and causes aneuploidy in Saccharomyces cerevisiae.

Journal: Journal of radiation research 20100101

Title: Induction of mitosis delay, apoptosis and aneuploidy in human cells by phenyl hydroquinone, an Ames test-negative carcinogen.

Journal: Genes & genetic systems 20090201

Title: Phenyl hydroquinone, an Ames test-negative carcinogen, induces Hog1-dependent stress response signaling.

Journal: The FEBS journal 20081101

Title: Molecular cytotoxic mechanisms of catecholic polychlorinated biphenyl metabolites in isolated rat hepatocytes.

Journal: Chemico-biological interactions 20070501

Title: Ames test-negative carcinogen, ortho-phenyl phenol, binds tubulin and causes aneuploidy in budding yeast.

Journal: Mutation research 20070401

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SDS
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Tags:3061-36-7 Molecular Formula|3061-36-7 MDL|3061-36-7 SMILES|3061-36-7 Benzene, 1,4-diphenoxy-
Catalog No.: AA0030LQ
3061-36-7,MFCD00038368
3061-36-7 | Benzene, 1,4-diphenoxy-
Pack Size： 5g
Purity： 95%
in stock
$27.00 $19.00
Pack Size： 25g
Purity： 95%
in stock
$64.00 $45.00
Pack Size： 100g
Purity： 95%
in stock
$186.00 $130.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0030LQ
Chemical Name: Benzene, 1,4-diphenoxy-
CAS Number: 3061-36-7
Molecular Formula: C18H14O2
Molecular Weight: 262.3026
MDL Number: MFCD00038368
SMILES: c1ccc(cc1)Oc1ccc(cc1)Oc1ccccc1
Properties
Complexity: 231  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 20  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 5.7  
Downstream Synthesis Route
106-39-8    100-67-4    7005-72-3    3061-36-7 

[1]Suter;Green[JournaloftheAmericanChemicalSociety,1937,vol.59,p.2578]

[2]Suter;Green[JournaloftheAmericanChemicalSociety,1937,vol.59,p.2578]

79-37-8    3061-36-7   
4,4'-Bis-(4-phenoxy-phenoxy)-benzil 

[1]Arbusow;Achmed-Sade[ZhurnalObshcheiKhimii,1942,vol.12,p.212,216][Chem.Abstr.,1943,p.2733]

106-37-6    100-67-4    3061-36-7 

[1]Ullmann;Sponagel[ChemischeBerichte,1905,vol.38,p.2212][JustusLiebigsAnnalenderChemie,1906,vol.350,p.103]

3061-36-7    41318-76-7 

[1]Kotera;Go[NipponKagakuKaishi/JournaloftheChemicalSocietyofJapan,1940,vol.61,p.455,458][Chem.Abstr.,1940,p.5712]

3061-36-7    192-93-8    208-37-7    121073-92-5 

[1]Hellwinkel,Dieter;Kistenmacher,Thomas[LiebigsAnnalenderChemie,1989,p.945-950]

[2]Okazaki,Takao;Nakagawa,Madoka;Futemma,Takeshi;Kitagawa,Toshikazu[JournalofPhysicalOrganicChemistry,2016,vol.29,#2,p.107-111]

Literature fold

Title: Molecular modeling study and synthesis of novel dicationic flexible triaryl guanidines and imidamides as antiprotozoal agents.

Journal: European journal of medicinal chemistry20111201

Title: Hydroquinone, a benzene metabolite, induces Hog1-dependent stress response signaling and causes aneuploidy in Saccharomyces cerevisiae.

Journal: Journal of radiation research20100101

Title: Induction of mitosis delay, apoptosis and aneuploidy in human cells by phenyl hydroquinone, an Ames test-negative carcinogen.

Journal: Genes & genetic systems20090201

Title: Phenyl hydroquinone, an Ames test-negative carcinogen, induces Hog1-dependent stress response signaling.

Journal: The FEBS journal20081101

Title: Molecular cytotoxic mechanisms of catecholic polychlorinated biphenyl metabolites in isolated rat hepatocytes.

Journal: Chemico-biological interactions20070501

Title: Ames test-negative carcinogen, ortho-phenyl phenol, binds tubulin and causes aneuploidy in budding yeast.

Journal: Mutation research20070401

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