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4-(4-Aminophenyl)-1,2,4-triazolidine-3,5-dione

HCID 11736331
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Basic information

CAS
140707-19-3
Standard SMILES
Nc1ccc(-n2c(=O)[nH][nH]c2=O)cc1
InChIKey
BROWTRWEXZXSAD-UHFFFAOYSA-N
Molecular formula
C8H8N4O2
Average molar mass
192.17 g/mol
Monoisotopic mass
192.06472551

Names & identifiers

Preferred name
4-(4-Aminophenyl)-1,2,4-triazolidine-3,5-dione
IUPAC
4-(4-aminophenyl)-1,2,4-triazolidine-3,5-dione

Names & synonyms

4-(4-aminophenyl)-1,2,4-triazolidine-3,5-dione140707-19-31,2,4-Triazolidine-3,5-dione, 4-(4-aminophenyl)-MFCD09928736SCHEMBL11876869DTXSID50471382AKOS000166969AS-67771SY490448EN300-70357D85691

Database identifiers

CAS
140707-19-3
PubChem CID
11736331
DTXSID
DTXSID50471382
Nikkaji
J1.503.201D

Properties

Computed structural properties

XLogP
0
Topological polar surface area
87.5 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
14
Formal charge
0
Complexity
244

Related reactions

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Compound notes

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