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120-02-5 | Acetic acid, 2,2'-[[[4-[(aminocarbonyl)amino]phenyl]arsinidene]bis(thio)]bis-
CAS No: 120-02-5 Catalog No: AG000Q0H MDL No:
Product Description
Catalog Number:
AG000Q0H
Chemical Name:
Acetic acid, 2,2'-[[[4-[(aminocarbonyl)amino]phenyl]arsinidene]bis(thio)]bis-
CAS Number:
120-02-5
Molecular Formula:
C11H13AsN2O5S2
Molecular Weight:
392.2829
IUPAC Name:
2-[[4-(carbamoylamino)phenyl]-(carboxymethylsulfanyl)arsanyl]sulfanylacetic acid
InChI:
InChI=1S/C11H13AsN2O5S2/c13-11(19)14-8-3-1-7(2-4-8)12(20-5-9(15)16)21-6-10(17)18/h1-4H,5-6H2,(H,15,16)(H,17,18)(H3,13,14,19)
InChI Key:
VULRLPILKVVAQO-UHFFFAOYSA-N
SMILES:
OC(=O)CS[As](c1ccc(cc1)NC(=O)N)SCC(=O)O
UNII:
5ZBS38PFRD
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
391.948g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
392.276g/mol
Monoisotopic Mass:
391.948g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
180A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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