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869697-23-4 | Amidosulfurous acid, (2-amino-1-iminoethylidene)-
CAS No: 869697-23-4 Catalog No: AG004O3K MDL No:
Product Description
Catalog Number:
AG004O3K
Chemical Name:
Amidosulfurous acid, (2-amino-1-iminoethylidene)-
CAS Number:
869697-23-4
Molecular Formula:
C2H5N3O2S
Molecular Weight:
135.1450
IUPAC Name:
1-amino-2-imino-1-sulfinoiminoethane
InChI:
InChI=1S/C2H5N3O2S/c3-1-2(4)5-8(6)7/h1,3H,(H2,4,5)(H,6,7)
InChI Key:
AURHYYGSUMKEDB-UHFFFAOYSA-N
SMILES:
NC(=NS(=O)O)C=N
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.01g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
135.141g/mol
Monoisotopic Mass:
135.01g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
-0.5
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