Basic information
- CAS
30953-40-3- Standard SMILES
Cl.Cl.NC(N)=Nc1ccnc(N=C(N)N)n1- InChIKey
MDUXHCGUMBJGMO-UHFFFAOYSA-N- Molecular formula
- C6H12Cl2N8
- Average molar mass
- 267.12 g/mol
- Monoisotopic mass
- 266.0561978
Names & identifiers
- Preferred name
- Guanidine, 1,1'-(2,4-pyrimidinediyl)di-, dihydrochloride
- IUPAC
- 2-[2-(diaminomethylideneamino)pyrimidin-4-yl]guanidine;dihydrochloride
Names & synonyms
2,4-Diguanidinopyrimidine dihydrochloride30953-40-31,1'-(2,4-Pyrimidinyl)diguanidine dihydrochlorideGUANIDINE, 1,1'-(2,4-PYRIMIDINEDIYL)DI-, DIHYDROCHLORIDEDTXSID00184930RefChem:346788DTXCID40107421N'',N'''-Pyrimidine-2,4-diyldiguanidine--hydrogen chloride (1/2)
Database identifiers
- CAS
30953-40-3- PubChem CID
- 35690
- DTXSID
DTXSID00184930
Properties
Computed structural properties
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 238
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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