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13945-53-4 | Carbamic acid, N-[(4-chlorophenyl)sulfonyl]-, ethyl ester
CAS No: 13945-53-4 Catalog No: AG001B27 MDL No:
Product Description
Catalog Number:
AG001B27
Chemical Name:
Carbamic acid, N-[(4-chlorophenyl)sulfonyl]-, ethyl ester
CAS Number:
13945-53-4
Molecular Formula:
C9H10ClNO4S
Molecular Weight:
263.6980
IUPAC Name:
ethyl N-(4-chlorophenyl)sulfonylcarbamate
InChI:
InChI=1S/C9H10ClNO4S/c1-2-15-9(12)11-16(13,14)8-5-3-7(10)4-6-8/h3-6H,2H2,1H3,(H,11,12)
InChI Key:
FACGRORYCNHVPV-UHFFFAOYSA-N
SMILES:
CCOC(=O)NS(=O)(=O)c1ccc(cc1)Cl
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.002g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.692g/mol
Monoisotopic Mass:
263.002g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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