1-(isocyanatomethylsulfonyl)-4-methylbenzene

Modify Date: 2025-08-25 19:52:56

1-(isocyanatomethylsulfonyl)-4-methylbenzene Structure
1-(isocyanatomethylsulfonyl)-4-methylbenzene structure
Common Name 1-(isocyanatomethylsulfonyl)-4-methylbenzene
CAS Number 10564-55-3 Molecular Weight 211.23800
Density N/A Boiling Point N/A
Molecular Formula C9H9NO3S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 1-(isocyanatomethylsulfonyl)-4-methylbenzene
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C9H9NO3S
Molecular Weight 211.23800
Exact Mass 211.03000
PSA 71.95000
LogP 2.14280
InChIKey IAYSDKUKIIYRRA-UHFFFAOYSA-N
SMILES Cc1ccc(S(=O)(=O)CN=C=O)cc1

 Synthetic Route

~51%

1-(isocyanatomethylsulfonyl)-4-methylbenzene Structure

1-(isocyanatome...

CAS#:10564-55-3

Literature: Le, Hoang V.; Ganem, Bruce Tetrahedron Letters, 2014 , vol. 55, # 12 p. 2003 - 2005

 Synonyms

p-tolylsulfonylmethyl isocyanide
tosylmethylisocyanate
toluene-4-sulfonylmethylisocyanide
p-toluenesulfonylmethyl isocyanate
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