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113780-49-7 | Benzenesulfonamide, N,N-dichloro-4-methoxy-
CAS No: 113780-49-7 Catalog No: AG0009N2 MDL No:MFCD27986175
Product Description
Catalog Number:
AG0009N2
Chemical Name:
Benzenesulfonamide, N,N-dichloro-4-methoxy-
CAS Number:
113780-49-7
Molecular Formula:
C7H7Cl2NO3S
Molecular Weight:
256.1064
MDL Number:
MFCD27986175
IUPAC Name:
N,N-dichloro-4-methoxybenzenesulfonamide
InChI:
InChI=1S/C7H7Cl2NO3S/c1-13-6-2-4-7(5-3-6)14(11,12)10(8)9/h2-5H,1H3
InChI Key:
YZTOPKJWINQAGP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)S(=O)(=O)N(Cl)Cl
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.952g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.097g/mol
Monoisotopic Mass:
254.952g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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