CAS
37041-07-9 Purity
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37041-07-9 Purity
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METHYL 2-(METHYLTHIO)BENZOATE
CAS
3704-28-7
Catalog Number
ACM3704287
Category
Other Products
Molecular Weight
182.24
Molecular Formula
C9H10O2S
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Specification
Synonyms
methyl 2-(methylthio)benzoate, 2-Methylthiobenzoic acid, methyl ester, CID279586, NSC130740, ZINC04262539, Benzoic acid, 2-(methylthio)-, methyl ester, BENZOIC ACID,2-METHYLTHIO,METHYL ESTER, T6148820, 3704-28-7, InChI=1/C9H10O2S/c1-11-9(10)7-5-3-4-6-8(7)12-2/h3-6H,1-2H
IUPAC Name
methyl 2-methylsulfanylbenzoate
Canonical SMILES
COC(=O)C1=CC=CC=C1SC
InChI Key
CPQDZXPLQXZJGF-UHFFFAOYSA-N
Boiling Point
268.2ºC at 760mmHg
Melting Point
66-69ºC(lit.)
Flash Point
121.4ºC
Density
1.16g/cm³
Appearance
white to off-white powder
Exact Mass
182.04000
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
2
H-Bond Donor
0
Safety Description
24/25
WGK Germany
3
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