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Details

Stereochemistry ACHIRAL
Molecular Formula C13H11O.Na
Molecular Weight 206.2156
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM P-BENZYLPHENOL

SMILES

[Na+].[O-]C1=CC=C(CC2=CC=CC=C2)C=C1

InChI

InChIKey=UGOOLIMBWSFDJH-UHFFFAOYSA-M
InChI=1S/C13H12O.Na/c14-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11;/h1-9,14H,10H2;/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C13H11O
Molecular Weight 183.2258
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Stable expression of a human liver UDP-glucuronosyltransferase (UGT2B15) with activity toward steroid and xenobiotic substrates.
1994 Sep-Oct
Cloning and expression of a rat liver phenobarbital-inducible UDP-glucuronosyltransferase (2B12) with specificity for monoterpenoid alcohols.
1995 Oct 1
Measurement of estrogenic activity of chemicals for the development of new dental polymers.
2001 Aug-Oct
Synthesis of p-benzylcalix[4]arene and its sulfonated water soluble derivative.
2001 Dec 7
Engineering the CYP101 system for in vivo oxidation of unnatural substrates.
2001 Oct
Genotoxic activation of benzophenone and its two metabolites by human cytochrome P450s in SOS/umu assay.
2002 Aug 26
Comparison of the reporter gene assay for ER-alpha antagonists with the immature rat uterotrophic assay of 10 chemicals.
2003 Apr 30
Immature rat uterotrophic assay of 18 chemicals and Hershberger assay of 30 chemicals.
2003 Feb 1
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.
2006 Nov
Ligands to the (IRAP)/AT4 receptor encompassing a 4-hydroxydiphenylmethane scaffold replacing Tyr2.
2008 Jul 15
Discovery of novel 1-azoniabicyclo[2.2.2]octane muscarinic acetylcholine receptor antagonists.
2009 Apr 23
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:48:38 GMT 2023
Edited
by admin
on Fri Dec 15 18:48:38 GMT 2023
Record UNII
WEM8U3MPDP
Record Status Validated (UNII)
Record Version
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Name Type Language
SODIUM P-BENZYLPHENOL
Common Name English
Code System Code Type Description
PUBCHEM
23675758
Created by admin on Fri Dec 15 18:48:38 GMT 2023 , Edited by admin on Fri Dec 15 18:48:38 GMT 2023
PRIMARY
EPA CompTox
DTXSID00226546
Created by admin on Fri Dec 15 18:48:38 GMT 2023 , Edited by admin on Fri Dec 15 18:48:38 GMT 2023
PRIMARY
FDA UNII
WEM8U3MPDP
Created by admin on Fri Dec 15 18:48:38 GMT 2023 , Edited by admin on Fri Dec 15 18:48:38 GMT 2023
PRIMARY
ECHA (EC/EINECS)
231-462-3
Created by admin on Fri Dec 15 18:48:38 GMT 2023 , Edited by admin on Fri Dec 15 18:48:38 GMT 2023
PRIMARY
CAS
7563-63-5
Created by admin on Fri Dec 15 18:48:38 GMT 2023 , Edited by admin on Fri Dec 15 18:48:38 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE