1-Butanamine, N-ethylidene-
Basic information
- CAS
6898-74-4- Standard SMILES
CC=NCCCC- InChIKey
NKGJJLDEORZFKJ-UHFFFAOYSA-N- Molecular formula
- C6H13N
- Average molar mass
- 99.17 g/mol
- Monoisotopic mass
- 99.10479942
Names & identifiers
- Preferred name
- 1-Butanamine, N-ethylidene-
- IUPAC
- N-butylethanimine
- English name
- N-Butylethylideneamine
- Molecular formula
- C6H13N
- Molecular weight
- 99.17
Names & synonyms
1-Butanamine, N-ethylidene-6898-74-4Butylamine, N-ethylidene-N-Ethylidenebutylamine(1E)-N-ButylethanimineN-ethylidene-n-butylamineSCHEMBL862794SCHEMBL12164654DTXSID90337796NKGJJLDEORZFKJ-QPJJXVBHSA-NN-[(E)-Ethylidene]-1-butanamine #N-Butylethanimine
Show more names
N-Butylethylideneamine
Database identifiers
- CAS
6898-74-4- PubChem CID
- 544735
- DTXSID
DTXSID90337796- Nikkaji
- J129.216A
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 12.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 48.1
Physicochemical properties
- Boiling point
- 98 · 98-106 °C
- Density
- 0.7513 g/cm3 · 0.7513 g/cm3
- pka
- 7.46 · 7.46±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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