2,5-Dimethylheptane-1,4,7-triamine
Basic information
- CAS
114662-79-2- Standard SMILES
CC(CN)CC(N)C(C)CCN- InChIKey
NPNWQHCXLCJOIK-UHFFFAOYSA-N- Molecular formula
- C9H23N3
- Average molar mass
- 173.3 g/mol
- Monoisotopic mass
- 173.18919775
Names & identifiers
- Preferred name
- 2,5-Dimethylheptane-1,4,7-triamine
- IUPAC
- 2,5-dimethylheptane-1,4,7-triamine
Names & synonyms
114662-79-22,5-DIMETHYLHEPTANE-1,4,7-TRIAMINESCHEMBL118505DTXSID60619435
Database identifiers
- CAS
114662-79-2- PubChem CID
- 21885387
- DTXSID
DTXSID60619435
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 106
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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