N3-Propyl-1H-1,2,4-triazole-3,5-diamine
Basic information
- CAS
87253-78-9- Standard SMILES
CCCNc1n[nH]c(N)n1- InChIKey
MQJLXZBPFLYTIJ-UHFFFAOYSA-N- Molecular formula
- C5H11N5
- Average molar mass
- 141.18 g/mol
- Monoisotopic mass
- 141.10144537
Names & identifiers
- Preferred name
- N3-Propyl-1H-1,2,4-triazole-3,5-diamine
- IUPAC
- 3-N-propyl-1H-1,2,4-triazole-3,5-diamine
- English name
- 1H-1,2,4-Triazole-3,5-diamine,N-propyl-(9CI)
- Molecular formula
- C5H11N5
- Molecular weight
- 141.17
Names & synonyms
N3-Propyl-1H-1,2,4-triazole-3,5-diamine87253-78-93-N-propyl-1H-1,2,4-triazole-3,5-diamineSCHEMBL5174425SCHEMBL16253865DTXSID20461518MQJLXZBPFLYTIJ-UHFFFAOYSA-NAKOS006337856AKOS013498226N5-Propyl-1H-[1,2,4]triazole-3,5-diamineN~3~-Propyl-1H-1,2,4-triazole-3,5-diamineN-propyl-1H-1,2,4-Triazole-3,5-diaMine
Show more names
N5-Propyl-1H-1,2,4-triazole-3,5-diamine5-(propylamino)-2H-1,2,4-triazol-3-amine1H-1,2,4-Triazole-3,5-diamine, N5-propyl-1H-1,2,4-Triazole-3,5-diamine,N-propyl-(9CI)
Database identifiers
- CAS
87253-78-9- PubChem CID
- 11298014
- DTXSID
DTXSID20461518
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 79.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 96
Physicochemical properties
- storage temp.
- 2 · 2-8°C
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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