Home Sulfos 5-amino-2-methanesulfonamidobenzoic acid

5-amino-2-methanesulfonamidobenzoic acid

CAS No.:
1154379-40-4
Catalog Number:
AG01AA80
Molecular Formula:
C8H10N2O4S
Molecular Weight:
230.2410
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Product Description
Catalog Number:
AG01AA80
Chemical Name:
5-amino-2-methanesulfonamidobenzoic acid
CAS Number:
1154379-40-4
Molecular Formula:
C8H10N2O4S
Molecular Weight:
230.2410
MDL Number:
MFCD12086083
IUPAC Name:
5-amino-2-(methanesulfonamido)benzoic acid
InChI:
InChI=1S/C8H10N2O4S/c1-15(13,14)10-7-3-2-5(9)4-6(7)8(11)12/h2-4,10H,9H2,1H3,(H,11,12)
InChI Key:
ZFQSDJZMNGJQNO-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)C(=O)O)NS(=O)(=O)C
Properties
Complexity:
335  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.036g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
230.238g/mol
Monoisotopic Mass:
230.036g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties