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3-Amino-4-(hydroxyamino)cyclobut-3-ene-1,2-dione

HCID 178767066
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Basic information

CAS
178324-47-5
Standard SMILES
Nc1c(NO)c(=O)c1=O
InChIKey
VPHVPEFKFUIHHW-UHFFFAOYSA-N
Molecular formula
C4H4N2O3
Average molar mass
128.09 g/mol

Names & identifiers

Preferred name
3-Amino-4-(hydroxyamino)cyclobut-3-ene-1,2-dione
IUPAC
3-amino-4-(hydroxyamino)cyclobut-3-ene-1,2-dione
English name
3-Cyclobutene-1,2-dione,3-amino-4-(hydroxyamino)-(9CI)
Molecular formula
C4H4N2O3
Molecular weight
128.08616

Names & synonyms

178324-47-53-Amino-4-(hydroxyamino)cyclobut-3-ene-1,2-dione3-Cyclobutene-1,2-dione,3-amino-4-(hydroxyamino)-(9CI)DB-2715633-CYCLOBUTENE-1,2-DIONE, 3-AMINO-4-(HYDROXYAMINO)-

Database identifiers

CAS
178324-47-5

Properties

Computed structural properties

XLogP
-0.6
Topological polar surface area
92.4 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
1
Heavy atoms
9
Formal charge
0
Complexity
218

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