Home Other Building Blocks 101-53-1
101-53-1,MFCD00002384
Catalog No.:AA0003DG

101-53-1 | 4-Benzylphenol

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Purity
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Price(USD)
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1g
98%
in stock  
$23.00   $16.00
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5g
98%
in stock  
$42.00   $29.00
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25g
>98.0%(GC)
in stock  
$93.00   $65.00
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500g
>98.0%(GC)
in stock  
$943.00   $660.00
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  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0003DG
Chemical Name:
4-Benzylphenol
CAS Number:
101-53-1
Molecular Formula:
C13H12O
Molecular Weight:
184.2338
MDL Number:
MFCD00002384
SMILES:
Oc1ccc(cc1)Cc1ccccc1
NSC Number:
8078
Properties
Properties
 
BP:
198-200°C at 760 mmHg  
Form:
Solid  
MP:
79-81 °C  
Refractive Index:
1.5641 (estimate)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
153  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
3.5  

Literature

Title: Agonistic effects of diverse xenobiotics on the constitutive androstane receptor as detected in a recombinant yeast-cell assay.

Journal: Toxicology in vitro : an international journal published in association with BIBRA 20180201

Title: Predicting anti-androgenic activity of bisphenols using molecular docking and quantitative structure-activity relationships.

Journal: Chemosphere 20161101

Title: Changing the substrate specificity of P450cam towards diphenylmethane by semi-rational enzyme engineering.

Journal: Protein engineering, design & selection : PEDS 20110501

Title: Identification and characterization of novel sirtuin inhibitor scaffolds.

Journal: Bioorganic & medicinal chemistry 20091001

Title: Discovery of novel 1-azoniabicyclo[2.2.2]octane muscarinic acetylcholine receptor antagonists.

Journal: Journal of medicinal chemistry 20090423

Title: Ligands to the (IRAP)/AT4 receptor encompassing a 4-hydroxydiphenylmethane scaffold replacing Tyr2.

Journal: Bioorganic & medicinal chemistry 20080715

Title: Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.

Journal: Journal of molecular graphics & modelling 20061101

Title: Comparison of the reporter gene assay for ER-alpha antagonists with the immature rat uterotrophic assay of 10 chemicals.

Journal: Toxicology letters 20030430

Title: Immature rat uterotrophic assay of 18 chemicals and Hershberger assay of 30 chemicals.

Journal: Toxicology 20030201

Title: Genotoxic activation of benzophenone and its two metabolites by human cytochrome P450s in SOS/umu assay.

Journal: Mutation research 20020826

Title: Synthesis of p-benzylcalix[4]arene and its sulfonated water soluble derivative.

Journal: Chemical communications (Cambridge, England) 20011207

Title: Engineering the CYP101 system for in vivo oxidation of unnatural substrates.

Journal: Protein engineering 20011001

Title: Measurement of estrogenic activity of chemicals for the development of new dental polymers.

Journal: Toxicology in vitro : an international journal published in association with BIBRA 20010101

Title: Cloning and expression of a rat liver phenobarbital-inducible UDP-glucuronosyltransferase (2B12) with specificity for monoterpenoid alcohols.

Journal: Archives of biochemistry and biophysics 19951001

Title: Stable expression of a human liver UDP-glucuronosyltransferase (UGT2B15) with activity toward steroid and xenobiotic substrates.

Journal: Drug metabolism and disposition: the biological fate of chemicals 19940101

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SDS
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