Clorophene

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Systematic / IUPAC Name: 2-Benzyl-4-chlorophenol

ID: Reference2804

Other Names: Bio-clave;
Chlorophene;
Clorofene;
Clorophen;
Ketolin H ; more

Formula: C13H11ClO

Class: Therapeutics/Prescription Drugs Extractables/Leachables Industrial Chemicals Pesticides/Herbicides Textile Chemicals/Auxiliary/Dyes Personal Care Products/Cosmetics

Spectral Data

Clorophene mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 3
No. of Spectra 282
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/29/2018 8:44:49 AM
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Identificators

InChI InChI=1S/C13H11ClO/c14-12-6-7-13(15)11(9-12)8-10-4-2-1-3-5-10/h1-7,9,15H,8H2
InChI Key NCKMMSIFQUPKCK-UHFFFAOYSA-N
Canonical SMILES C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)O
CAS 120321
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Other Names Bio-clave;
Chlorophene;
Clorofene;
Clorophen;
Ketolin H;
Neosabenyl;
Neosobenil;
Nipacide BCP;
Preventol B;
Preventol BP;
Santophen I;
Sentiphene;
Septiphene;
o-Benzyl-p-chlorophenol;
o-Cresol, 4-chloro-α-phenyl-;
p-Chloro-o-benzylphenol;
2-Benzyl-4-chloro-phenol;
2-Hydroxy-5-chlorodiphenylmethane;
4-Chloranyl-2-(phenylmethyl)phenol;
4-Chloro-α-phenyl-o-cresol;
4-Chloro-2-(phenylmethyl)phenol;
4-Chloro-2-benzylphenol;
5-Chloro-2-hydroxydiphenylmethane;
Benzyl-p-chlorophenol;
Benzylchlorophenol;
Orthobenzyl-p-chlorophenol;
Orthobenzylparachlorophenol;
Phenol, 4-chloro-2-(phenylmethyl)-;
Phenol, 4-chloro-2-benzyl-

In Other Databases

ChemIDPlus 000120321; 035471499; 003184654
ChemSpider 8118
ChEMBL CHEMBL1328919
PubChem 8425
KEGG D03564