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952182-65-9 | N-[2-(hydroxymethyl)phenyl]-4-iodobenzene-1-sulfonamide
CAS No: 952182-65-9 Catalog No: AG00IZSR MDL No:MFCD09027185
Product Description
Catalog Number:
AG00IZSR
Chemical Name:
N-[2-(hydroxymethyl)phenyl]-4-iodobenzene-1-sulfonamide
CAS Number:
952182-65-9
Molecular Formula:
C13H12INO3S
Molecular Weight:
389.2088
MDL Number:
MFCD09027185
IUPAC Name:
N-[2-(hydroxymethyl)phenyl]-4-iodobenzenesulfonamide
InChI:
InChI=1S/C13H12INO3S/c14-11-5-7-12(8-6-11)19(17,18)15-13-4-2-1-3-10(13)9-16/h1-8,15-16H,9H2
InChI Key:
JGPMHZBKFFMVJP-UHFFFAOYSA-N
SMILES:
OCc1ccccc1NS(=O)(=O)c1ccc(cc1)I
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
388.958g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
389.207g/mol
Monoisotopic Mass:
388.958g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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