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187831-22-7 | Methanesulfonamide, N-[4-[(1S)-2-chloro-1-hydroxyethyl]phenyl]-
CAS No: 187831-22-7 Catalog No: AG002GJC MDL No:MFCD09863636
Product Description
Catalog Number:
AG002GJC
Chemical Name:
Methanesulfonamide, N-[4-[(1S)-2-chloro-1-hydroxyethyl]phenyl]-
CAS Number:
187831-22-7
Molecular Formula:
C9H12ClNO3S
Molecular Weight:
249.7145
MDL Number:
MFCD09863636
IUPAC Name:
N-[4-[(1S)-2-chloro-1-hydroxyethyl]phenyl]methanesulfonamide
InChI:
InChI=1S/C9H12ClNO3S/c1-15(13,14)11-8-4-2-7(3-5-8)9(12)6-10/h2-5,9,11-12H,6H2,1H3/t9-/m1/s1
InChI Key:
UMJVCKLQCMEZSH-SECBINFHSA-N
SMILES:
ClC[C@H](c1ccc(cc1)NS(=O)(=O)C)O
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
249.023g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
249.709g/mol
Monoisotopic Mass:
249.023g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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