CAS 15362-40-0|1-(2,6-dichlorophenyl)-2,3-dihydro-1H-indol-2-one|1-(2,6-Dichlorophenyl)indolin-2-one|1-(2,6-dichlorophenyl)-3H-indol-2-one|1-(2,6-Dichlorophenyl)-1,3-dihydro-indole-2-one|1-(2,6-Dich...

General Information

Structure

Molecular Formula

C₁₄H₉Cl₂NO

Molecular Mass

278.13336

Exact Mass

277.00611927

Charge

InChI

InChI=1S/C14H9Cl2NO/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(17)18/h1-7H,8H2

InChIKey

JCICIFOYVSPMHG-UHFFFAOYSA-N

Canonic Smiles

O=C1Cc2c(N1c1c(Cl)cccc1Cl)cccc2

Isomeric Smiles

N1(C(=O)Cc2ccccc12)c1c(cccc1Cl)Cl

Calculated Properties

JChem

Acid pKa

11.820759

H Acceptors

H Donor

LogD (pH = 5.5)

3.8021638

LogD (pH = 7.4)

3.8021476

Log P

3.802164

Molar Refractivity

72.088

Polarizability

27.829924

Polar Surface Area

20.31

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

IUPAC name

1-(2,6-dichlorophenyl)-2,3-dihydro-1H-indol-2-one

Synonyms

1-(2,6-Dichlorophenyl)indolin-2-one1-(2,6-Dichlorophenyl)-1,3-dihydro-indole-2-one1-(2,6-Dichlorophenyl)-2-indolinoneNSC 6218451-(2,6-Dichlorophenyl)oxindoleDiclofenac Amide1-(2,6-Dichlorophenyl)-1,3-dihydro-2H-indol-2-oneDiclofenac LactamN-(2,6-dichlorophenyl)-2-indolinone

IUPAC Traditional name

1-(2,6-dichlorophenyl)-3H-indol-2-one

Names and Identifiers

Registration numbers

CAS Number

PubChem SID

PubChem CID

MDL Number