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1927874-06-3 | 2-(1H-pyrazol-4-yl)ethane-1-sulfonamide
CAS No: 1927874-06-3 Catalog No: AG01BAXJ MDL No:
Product Description
Catalog Number:
AG01BAXJ
Chemical Name:
2-(1H-pyrazol-4-yl)ethane-1-sulfonamide
CAS Number:
1927874-06-3
Molecular Formula:
C5H9N3O2S
Molecular Weight:
175.2089
IUPAC Name:
2-(1H-pyrazol-4-yl)ethanesulfonamide
InChI:
InChI=1S/C5H9N3O2S/c6-11(9,10)2-1-5-3-7-8-4-5/h3-4H,1-2H2,(H,7,8)(H2,6,9,10)
InChI Key:
XNADUJOKCVZYQS-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)CCc1c[nH]nc1
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.042g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
175.206g/mol
Monoisotopic Mass:
175.042g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
97.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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