Name: Name:3,3,4,5-Tetrachlorobiphenyl
Brand: Angene
SKU: AG0069G3
Rating: 90 (10 reviews)

3,3,4,5-Tetrachlorobiphenyl

CAS No.:

70362-49-1

Catalog Number:

AG0069G3

Molecular Formula:

C12H8Cl4

Molecular Weight:

294.0039

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Product Description

Catalog Number:

AG0069G3

Chemical Name:

3,3,4,5-Tetrachlorobiphenyl

CAS Number:

70362-49-1

Molecular Formula:

C12H8Cl4

Molecular Weight:

294.0039

MDL Number:

MFCD00152852

IUPAC Name:

1,2,3-trichloro-5-(3-chlorophenyl)benzene

InChI:

InChI=1S/C12H6Cl4/c13-9-3-1-2-7(4-9)8-5-10(14)12(16)11(15)6-8/h1-6H

InChI Key:

SXFLURRQRFKBNN-UHFFFAOYSA-N

SMILES:

ClC1=C(Cl)C(CC(=C1)c1ccccc1)(Cl)Cl

UNII:

M3Y0MO1SUK

Properties

Complexity:

221

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

291.919g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

291.98g/mol

Monoisotopic Mass:

289.922g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

0A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

6.1

Literature

Title	Journal
Induction of cytochrome P450 1B1 in MDA-MB-231 human breast cancer cells by non-ortho-substituted polychlorinated biphenyls.	Toxicology in vitro : an international journal published in association with BIBRA 20021201