Benzene, 1-[(isocyanophenylmethyl)sulfonyl]-4-methyl-


Chemical Name: Benzene, 1-[(isocyanophenylmethyl)sulfonyl]-4-methyl-
CAS Number: 36635-66-2
Product Number: AG00C0ZT(AGN-PC-0NDNKU)
Synonyms:
MDL No:
Molecular Formula: C15H13NO2S
Molecular Weight: 271.3342

Identification/Properties


Computed Properties
Molecular Weight:
271.334g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
271.067g/mol
Monoisotopic Mass:
271.067g/mol
Topological Polar Surface Area:
46.9A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
429
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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