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114317-18-9 | Benzoic acid, 2-[(aminosulfonyl)methyl]-, hydrazide
CAS No: 114317-18-9 Catalog No: AG000B2Z MDL No:
Product Description
Catalog Number:
AG000B2Z
Chemical Name:
Benzoic acid, 2-[(aminosulfonyl)methyl]-, hydrazide
CAS Number:
114317-18-9
Molecular Formula:
C8H11N3O3S
Molecular Weight:
229.2562
IUPAC Name:
[2-(hydrazinecarbonyl)phenyl]methanesulfonamide
InChI:
InChI=1S/C8H11N3O3S/c9-11-8(12)7-4-2-1-3-6(7)5-15(10,13)14/h1-4H,5,9H2,(H,11,12)(H2,10,13,14)
InChI Key:
DYIKWRXAXHMLRT-UHFFFAOYSA-N
SMILES:
NNC(=O)c1ccccc1CS(=O)(=O)N
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.052g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
229.254g/mol
Monoisotopic Mass:
229.052g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6
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