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849793-87-9 | Carbamic acid,N-[(5-chloro-2-thienyl)sulfonyl]-, ethyl ester
CAS No: 849793-87-9 Catalog No: AG0051ZR MDL No:
Product Description
Catalog Number:
AG0051ZR
Chemical Name:
Carbamic acid,N-[(5-chloro-2-thienyl)sulfonyl]-, ethyl ester
CAS Number:
849793-87-9
Molecular Formula:
C7H7ClNO4S2-
Molecular Weight:
268.7178
IUPAC Name:
ethyl N-(5-chlorothiophen-2-yl)sulfonylcarbamate
InChI:
InChI=1S/C7H8ClNO4S2/c1-2-13-7(10)9-15(11,12)6-4-3-5(8)14-6/h3-4H,2H2,1H3,(H,9,10)
InChI Key:
XALLJMFDLUYTTF-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)c1ccc(s1)Cl)C(=O)[O-]
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.958g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.714g/mol
Monoisotopic Mass:
268.958g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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