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86869-38-7 | Acetic acid, [4-[[(aminocarbonyl)amino]sulfonyl]phenoxy]-
CAS No: 86869-38-7 Catalog No: AG004ICV MDL No:
Product Description
Catalog Number:
AG004ICV
Chemical Name:
Acetic acid, [4-[[(aminocarbonyl)amino]sulfonyl]phenoxy]-
CAS Number:
86869-38-7
Molecular Formula:
C9H10N2O6S
Molecular Weight:
274.2505
IUPAC Name:
2-[4-(carbamoylsulfamoyl)phenoxy]acetic acid
InChI:
InChI=1S/C9H10N2O6S/c10-9(14)11-18(15,16)7-3-1-6(2-4-7)17-5-8(12)13/h1-4H,5H2,(H,12,13)(H3,10,11,14)
InChI Key:
WWBPVHMFZLEKAO-UHFFFAOYSA-N
SMILES:
OC(=O)COc1ccc(cc1)S(=O)(=O)NC(=O)N
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.026g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
274.247g/mol
Monoisotopic Mass:
274.026g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
144A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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