Basic information
- CAS
31414-50-3- Standard SMILES
Cc1cnc(N=C(N)N)nc1N=C(N)N- InChIKey
NCRMXGONWCWVSY-UHFFFAOYSA-N- Molecular formula
- C7H12N8
- Average molar mass
- 208.22 g/mol
- Monoisotopic mass
- 208.11849242
Names & identifiers
- Preferred name
- Guanidine, 1,1'-(5-methylpyrimidine-2,4-diyl)di-
- IUPAC
- 2-[2-(diaminomethylideneamino)-5-methylpyrimidin-4-yl]guanidine
Names & synonyms
1,1'-(5-Methylpyrimidine-2,4-diyl)diguanidine31414-50-3BRN 0920681Pyrimidine, 2,4-diguanidino-5-methyl-GUANIDINE, 1,1'-(5-METHYLPYRIMIDINE-2,4-DIYL)DI-DTXSID601853425-25-12-00130 (Beilstein Handbook Reference)RefChem:346790DTXCID70107833N'',N'''-(5-Methylpyrimidine-2,4-diyl)diguanidine
Database identifiers
- CAS
31414-50-3- PubChem CID
- 35795
- DTXSID
DTXSID60185342
Properties
Computed structural properties
- XLogP
- -1.8
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 264
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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