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389070-77-3 | (2-BENZENESULFONYLAMINO-ACETYLAMINO)-ACETIC ACID
CAS No: 389070-77-3 Catalog No: AG00C034 MDL No:MFCD00761592
Product Description
Catalog Number:
AG00C034
Chemical Name:
(2-BENZENESULFONYLAMINO-ACETYLAMINO)-ACETIC ACID
CAS Number:
389070-77-3
Molecular Formula:
C10H12N2O5S
Molecular Weight:
272.2777
MDL Number:
MFCD00761592
IUPAC Name:
2-[[2-(benzenesulfonamido)acetyl]amino]acetic acid
InChI:
InChI=1S/C10H12N2O5S/c13-9(11-7-10(14)15)6-12-18(16,17)8-4-2-1-3-5-8/h1-5,12H,6-7H2,(H,11,13)(H,14,15)
InChI Key:
KEEQUKPFIGVVFR-UHFFFAOYSA-N
SMILES:
O=C(CNS(=O)(=O)c1ccccc1)NCC(=O)O
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.047g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
272.275g/mol
Monoisotopic Mass:
272.047g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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