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114115-85-4 | Hydrazinecarboxylic acid, 2-[2-(sulfooxy)phenyl]-
CAS No: 114115-85-4 Catalog No: AG000AMG MDL No:
Product Description
Catalog Number:
AG000AMG
Chemical Name:
Hydrazinecarboxylic acid, 2-[2-(sulfooxy)phenyl]-
CAS Number:
114115-85-4
Molecular Formula:
C7H8N2O6S
Molecular Weight:
248.2132
IUPAC Name:
(2-sulfooxyanilino)carbamic acid
InChI:
InChI=1S/C7H8N2O6S/c10-7(11)9-8-5-3-1-2-4-6(5)15-16(12,13)14/h1-4,8-9H,(H,10,11)(H,12,13,14)
InChI Key:
VESWPJCAWFUCGK-UHFFFAOYSA-N
SMILES:
OC(=O)NNc1ccccc1OS(=O)(=O)O
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.01g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
248.209g/mol
Monoisotopic Mass:
248.01g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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