4,4′-Bis(chloromethyl)biphenyl

C₁₄H₁₂Cl₂CAS 1667-10-3251.15 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₄H₁₂Cl₂
Molar mass: 251.15 g/mol
Exact mass: 250.0316 Da
Melting point: 136 °C
Boiling point: 235 °C
logP: 4.83Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Identifiers

CAS number

1667-10-3

SMILES

ClCc1ccc(-c2ccc(CCl)cc2)cc1

InChIKey

INZDTEICWPZYJM-UHFFFAOYSA-N

InChI

InChI=1S/C14H12Cl2/c15-9-11-1-5-13(6-2-11)14-7-3-12(10-16)4-8-14/h1-8H,9-10H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names

1,1′-Biphenyl, 4,4′-bis(chloromethyl)-
p,p′-Bitolyl, α,α′-dichloro-
4,4′-Bis(chloromethyl)-1,1′-biphenyl
4,4′-Bis(chloromethyl)diphenyl
p,p′-Bis(chloromethyl)biphenyl
NSC 74077
4,4′-Dichloromethyldiphenyl
1-(Chloromethyl)-4-[4-(chloromethyl)phenyl]benzene

Work with 4,4′-Bis(chloromethyl)biphenyl

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Xylylene dichloride623-25-680 % similar 4-Phenylbenzyl chloride1667-11-479 % similar 4-Chlorobenzyl chloride104-83-660 % similar 4-Fluorobenzyl chloride352-11-460 % similar Benzyl chloride100-44-758 % similar 4-Methylbenzyl chloride104-82-557 % similar 4-Ethylbenzyl chloride1467-05-657 % similar 4-Bromobenzyl chloride589-17-357 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook