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10149-44-7 | Benzenamine, 5-[(2-chloroethenyl)sulfonyl]-2-methoxy-
CAS No: 10149-44-7 Catalog No: AG0004LR MDL No:
Product Description
Catalog Number:
AG0004LR
Chemical Name:
Benzenamine, 5-[(2-chloroethenyl)sulfonyl]-2-methoxy-
CAS Number:
10149-44-7
Molecular Formula:
C9H10ClNO3S
Molecular Weight:
247.6986
IUPAC Name:
5-(2-chloroethenylsulfonyl)-2-methoxyaniline
InChI:
InChI=1S/C9H10ClNO3S/c1-14-9-3-2-7(6-8(9)11)15(12,13)5-4-10/h2-6H,11H2,1H3
InChI Key:
RKLRNOXYXCHXOS-UHFFFAOYSA-N
SMILES:
ClC=CS(=O)(=O)c1ccc(c(c1)N)OC
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.007g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.693g/mol
Monoisotopic Mass:
247.007g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.8
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