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13459-62-6

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13459-62-6 Structure

13459-62-6 Structure
IdentificationBack Directory
[Name]

Benzeneacetic acid, 2-[(4-chlorophenyl)thio]-
[CAS]

13459-62-6
[Synonyms]

2-[(4-Chlorophenyl)thio]benzeneacetic acid
[2-[(4-Chlorophenyl)thio]phenyl]acetic acid
Benzeneacetic acid, 2-[(4-chlorophenyl)thio]-
2-(2-((4-Chlorophenyl)thio)phenyl)acetic acid
[EINECS(EC#)]

200-001-8
[Molecular Formula]

C14H11ClO2S
[MDL Number]

MFCD04107422
[MOL File]

13459-62-6.mol
[Molecular Weight]

278.75
Chemical PropertiesBack Directory
[Melting point ]

116℃
[Boiling point ]

434.4±35.0 °C(Predicted)
[density ]

1.37±0.1 g/cm3(Predicted)
[pka]

4.13±0.10(Predicted)
[InChI]

InChI=1S/C14H11ClO2S/c15-11-5-7-12(8-6-11)18-13-4-2-1-3-10(13)9-14(16)17/h1-8H,9H2,(H,16,17)
[InChIKey]

WZICWIASCZNZHO-UHFFFAOYSA-N
[SMILES]

C1(CC(O)=O)=CC=CC=C1SC1=CC=C(Cl)C=C1
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