Basic information
- CAS
85771-13-7- Standard SMILES
CCCCNC/C=C/CN- InChIKey
CBTFQRPPQZVYQU-SNAWJCMRSA-N- Molecular formula
- C8H18N2
- Average molar mass
- 142.24 g/mol
- Monoisotopic mass
- 142.14699858
Names & identifiers
- Preferred name
- 2-Butene-1,4-diamine, N-butyl-
- IUPAC
- (E)-N'-butylbut-2-ene-1,4-diamine
Names & synonyms
2-Butene-1,4-diamine, N-butyl-85771-13-7
Database identifiers
- CAS
85771-13-7- PubChem CID
- 6441978
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 79.3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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