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Structure

3-{[(4-Chlorophenyl)thio]methyl}benzoic acid

CAS
30082-41-8
Catalog Number
ACM30082418
Category
Other Products
Molecular Weight
277.746000 [g/mol]
Molecular Formula
C14H11ClO2S

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Specification

Synonyms
ZINC03887746, CID7063521, 30082-41-8
IUPAC Name
3-[(4-chlorophenyl)sulfanylmethyl]benzoate
Canonical SMILES
C1=CC(=CC(=C1)CSC2=CC=C(C=C2)Cl)C(=O)O
InChI Key
SMSWCDAPANKIOU-UHFFFAOYSA-M
Boiling Point
460.7ºC at 760mmHg
Flash Point
232.4ºC
Density
1.37g/cm³
Exact Mass
278.01700
H-Bond Acceptor
2
H-Bond Donor
0
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