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167951-45-3 | 4-isocyanato-N-methylbenzenesulfonamide
CAS No: 167951-45-3 Catalog No: AG00AC5B MDL No:
Product Description
Catalog Number:
AG00AC5B
Chemical Name:
4-isocyanato-N-methylbenzenesulfonamide
CAS Number:
167951-45-3
IUPAC Name:
4-isocyanato-N-methylbenzenesulfonamide
InChI:
InChI=1S/C8H8N2O3S/c1-9-14(12,13)8-4-2-7(3-5-8)10-6-11/h2-5,9H,1H3
InChI Key:
NAIKKMCICPUVIJ-UHFFFAOYSA-N
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.026g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.223g/mol
Monoisotopic Mass:
212.026g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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