2,2',3',4,4',5,5'-HEPTACHLORO-3-BIPHENYLOL

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H3Cl7O
Molecular Weight	411.323
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,2',3',4,4',5,5'-HEPTACHLORO-3-BIPHENYLOL

Structure Search

SMILES

OC1=C(Cl)C(=CC(Cl)=C1Cl)C2=CC(Cl)=C(Cl)C(Cl)=C2Cl

InChI

InChIKey=JCUBQOKFGUXHFL-UHFFFAOYSA-N

InChI=1S/C12H3Cl7O/c13-5-1-3(7(15)11(19)9(5)17)4-2-6(14)10(18)12(20)8(4)16/h1-2,20H

HIDE SMILES / InChI

Molecular Formula	C12H3Cl7O
Molecular Weight	411.323
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Hydroxylated polychlorinated biphenyls selectively bind transthyretin in blood and inhibit amyloidogenesis: rationalizing rodent PCB toxicity.	2004-12	15610856
Potent inhibition of estrogen sulfotransferase by hydroxylated PCB metabolites: a novel pathway explaining the estrogenic activity of PCBs.	2000-05	10803601

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:36:34 GMT 2025` Edited by `admin` on `Mon Mar 31 20:36:34 GMT 2025`
Record UNII	1TO9EBC07Z
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2,2',3',4,4',5,5'-HEPTACHLORO-3-BIPHENYLOL

Systematic Name

English

3'-HYDROXY-PCB 180

Preferred Name

English

(1,1'-BIPHENYL)-3-OL, 2,2',3',4,4',5,5'-HEPTACHLORO-

Systematic Name

English

3-HYDROXY-2,2',3',4,4',5,5'-HEPTACHLOROBIPHENYL

Systematic Name

English

3'-HYDROXY-2,2',3,4,4',5,5'-HEPTACHLOROBIPHENYL

Systematic Name

English

2,2',3,4,4',5,5'-HEPTACHLORO-3'-HYDROXY-1,1'-BIPHENYL

Systematic Name

English

Code System Code Type Description

FDA UNII

1TO9EBC07Z

Created by admin on Mon Mar 31 20:36:34 GMT 2025 , Edited by admin on Mon Mar 31 20:36:34 GMT 2025

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CAS

158076-69-8

Created by admin on Mon Mar 31 20:36:34 GMT 2025 , Edited by admin on Mon Mar 31 20:36:34 GMT 2025

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EPA CompTox

DTXSID00166372

Created by admin on Mon Mar 31 20:36:34 GMT 2025 , Edited by admin on Mon Mar 31 20:36:34 GMT 2025

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PUBCHEM

644183

Created by admin on Mon Mar 31 20:36:34 GMT 2025 , Edited by admin on Mon Mar 31 20:36:34 GMT 2025

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