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5438-30-2 | 4-(1H-pyrrol-1-yl)benzene-1-sulfonamide
CAS No: 5438-30-2 Catalog No: AG01ACNO MDL No:MFCD01762129
Product Description
Catalog Number:
AG01ACNO
Chemical Name:
4-(1H-pyrrol-1-yl)benzene-1-sulfonamide
CAS Number:
5438-30-2
Molecular Formula:
C10H10N2O2S
Molecular Weight:
222.2636
MDL Number:
MFCD01762129
IUPAC Name:
4-pyrrol-1-ylbenzenesulfonamide
InChI:
InChI=1S/C10H10N2O2S/c11-15(13,14)10-5-3-9(4-6-10)12-7-1-2-8-12/h1-8H,(H2,11,13,14)
InChI Key:
HEROWGICZZJWKP-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)c1ccc(cc1)n1cccc1
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.046g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.262g/mol
Monoisotopic Mass:
222.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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