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CAS Number: 70958-70-2
5-acetyl-2-methylbenzenesulfonamide

Structure

 5-acetyl-2-methylbenzenesulfonamide
Name: 5-acetyl-2-methylbenzenesulfonamide
Synonyms:
General Information
Product Number: 70958702

CAS Registry Number 70958-70-2
Name:
Benzenesulfonamide, 5-?acetyl-?2-?methyl-
5-Acetyl-2-methylbenzenesulfonamide

 

Chemical Formula: C9H11NO3S
Exact Mass: 213.05
Molecular Weight: 213.25
m/z: 213.05 (100.0%), 214.05 (10.8%), 215.04 (4.5%), 215.05 (1.2%)

 

InChI:InChI=1S/C9H11NO3S/c1-6-3-4-8(7(2)11)5-9(6)14(10,12)13/h3-5H,1-2H3,(H2,10,12,13)

InChI Key:FOBJXKVZKYRFOO-UHFFFAOYSA-N

Canonical SMILES:CC1=C(C=C(C=C1)C(=O)C)S(=O)(=O)N

 

Thermal Properties Value Condition Note
Melting Point 208 °C Solv: ethanol (64-17-5) (1)IC
Melting Point 151-152 °C   (2)IC
Melting Point 141-146 °C Solv: isopropanol (67-63-0) (3)IC

Specification

98%
References
  1. (1) Shingare, M. S.; Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry 1979, V18B(3), P277-9 CAPLUS
  2. (2) Nakai, Goro; JP 62234059 A 1987 CAPLUS
  3. (3) Fujikura, Takashi; Chemical & Pharmaceutical Bulletin 1982, V30(11), P4092-101 CAPLUS
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