CAS 97-23-4|4-Chloro-2-(5-chloro-2-hydroxybenzyl)phenol|Bis(5-chloro-2-hydroxyphenyl)methane|5,5'-Dichloro-2,2'-dihydroxydiphenylmethane|4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol|trivex|Te...

General Information

Structure

Molecular Formula

C₁₃H₁₀Cl₂O₂

Molecular Mass

269.1233

Exact Mass

268.00578492

Charge

InChI

InChI=1S/C13H10Cl2O2/c14-10-1-3-12(16)8(6-10)5-9-7-11(15)2-4-13(9)17/h1-4,6-7,16-17H,5H2

InChIKey

MDNWOSOZYLHTCG-UHFFFAOYSA-N

Canonic Smiles

Oc1ccc(cc1Cc1cc(Cl)ccc1O)Cl

Isomeric Smiles

Clc1cc(c(cc1)O)Cc1cc(ccc1O)Cl

Calculated Properties

JChem

Acid pKa

7.210646

H Acceptors

H Donor

LogD (pH = 5.5)

4.6576724

LogD (pH = 7.4)

4.2583914

Log P

4.6659985

Molar Refractivity

69.3666

Polarizability

26.635624

Polar Surface Area

40.46

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Synonyms

4-Chloro-2-(5-chloro-2-hydroxybenzyl)phenol5,5'-Dichloro-2,2'-dihydroxydiphenylmethaneBis(5-chloro-2-hydroxyphenyl)methaneDicestal2,2'-Dihydroxy-5,5'-dichlorodiphenylmethaneDiclorofenDichlorophenDichloropheneDDDMTeniotolDichlorofenFungicide GM4,4'-Dichloro-2,2'-methylenediphenol5,5'-Dichloro-2,2'-dihydroxydiphenylmethaneVermithanaDichlorphenBis(chlorohydroxyphenyl)methaneDiphenthane 70Diphentane 70DDMDifentanEmbephenAnthiphen2,2'-Methylenebis[4-chlorophenol]2,2'-Methylenebis[4-chlorophenolDichlorophen2,2'-Methylenebis(4-chlorophenol)2,2'-亚甲基双(4-氯苯酚)DichloropheneDichlorophene 10Bis(2-hydroxy-5-chlorophenyl)methaneAntifenCordocelDidroxanDidroxaneDichlorophen B二氯芬双(5-氯-2-羟苯基)甲烷Bis(5-chloro-2-hydroxyphenyl)methane双氯酚双氯酚DichloropheneDichlorophen

IUPAC name

4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol

IUPAC Traditional name

trivex

Names and Identifiers

Registration numbers

Beilstein Number

1884514

MDL Number

MFCD00002322

CAS Number

97-23-4