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1-(Diaminomethylidene)-2-(2,4-dinitroanilino)guanidine;hydrochloride

HCID 54599152
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Basic information

CAS
51108-36-2
Standard SMILES
Cl.NC(N)=N/C(N)=N/Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]
InChIKey
OOFBLBWDGKECHH-UHFFFAOYSA-N
Molecular formula
C8H11ClN8O4
Average molar mass
318.68 g/mol
Monoisotopic mass
318.0591786

Names & identifiers

Preferred name
1-(Diaminomethylidene)-2-(2,4-dinitroanilino)guanidine;hydrochloride
IUPAC
1-(diaminomethylidene)-2-(2,4-dinitroanilino)guanidine;hydrochloride

Names & synonyms

51108-36-2DTXSID50712646NSC207092NSC-207092N''-{(E)-Amino[2-(2,4-dinitrophenyl)hydrazinylidene]methyl}guanidine--hydrogen chloride (1/1)

Database identifiers

CAS
51108-36-2
PubChem CID
54599152
DTXSID
DTXSID50712646

Properties

Computed structural properties

Topological polar surface area
206 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
21
Formal charge
0
Complexity
435

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