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137832-63-4 | Carbamic acid, N-[(2-chlorophenyl)sulfonyl]-, methyl ester
CAS No: 137832-63-4 Catalog No: AG0013X1 MDL No:
Product Description
Catalog Number:
AG0013X1
Chemical Name:
Carbamic acid, N-[(2-chlorophenyl)sulfonyl]-, methyl ester
CAS Number:
137832-63-4
Molecular Formula:
C8H8ClNO4S
Molecular Weight:
249.6714
IUPAC Name:
methyl N-(2-chlorophenyl)sulfonylcarbamate
InChI:
InChI=1S/C8H8ClNO4S/c1-14-8(11)10-15(12,13)7-5-3-2-4-6(7)9/h2-5H,1H3,(H,10,11)
InChI Key:
LLVFLMQXGZLNMD-UHFFFAOYSA-N
SMILES:
COC(=O)NS(=O)(=O)c1ccccc1Cl
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.986g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.665g/mol
Monoisotopic Mass:
248.986g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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