Basic information
- CAS
19435-69-9- Standard SMILES
CCCCNCCCCNCCCC- InChIKey
AHLHNAGJLPRDGU-UHFFFAOYSA-N- Molecular formula
- C12H28N2
- Average molar mass
- 200.36 g/mol
- Monoisotopic mass
- 200.2252489
Names & identifiers
- Preferred name
- 1,4-Butanediamine, N,N'-dibutyl-
- IUPAC
- N,N'-dibutylbutane-1,4-diamine
Names & synonyms
1,4-Butanediamine, N,N'-dibutyl-19435-69-9MD2SCHEMBL5701163DTXSID50332161N~1~,N~4~-Dibutylbutane-1,4-diamine
Database identifiers
- CAS
19435-69-9- PubChem CID
- 444473
- DTXSID
DTXSID50332161
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 24.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 82.3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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