Basic information
- CAS
42966-64-3- Standard SMILES
CCNC(C)CC(C)C- InChIKey
MJIATCLHNDSDRK-UHFFFAOYSA-N- Molecular formula
- C8H19N
- Average molar mass
- 129.24 g/mol
- Monoisotopic mass
- 129.15174961
Names & identifiers
- Preferred name
- N-Ethyl-1-amino-1,3-dimethylbutane
- IUPAC
- N-ethyl-4-methylpentan-2-amine
- English name
- N-Ethyl-1,3-dimethylbutan-1-amine
- Molecular formula
- C8H19N
- Molecular weight
- 129.24
Names & synonyms
N-Ethyl-1-amino-1,3-dimethylbutane42966-64-32-Pentanamine, N-ethyl-4-methyl-5171-66-4Ethyl-(1,3-dimethylbutyl)amineN-Ethyl-(1,3-dimethylbutyl)amineN-ethyl-4-methylpentan-2-amineNSC165672N-ETHYL-4-METHYL-2-PENTANEAMINESCHEMBL62860N-ethylisopropylpropan-2-amineSCHEMBL6722033
Show more names
N-Ethyl-4-methyl-2-pentanamineN-Ethyl(1,3-dimethylbutyl)amineN-Ethyl-1,3-dimethylbutan-1-amine
SCHEMBL6722034N-ethyl-isopropylpropan-2-amineN-ethyl-4-methylpent-2-ylamineDTXSID20965980N-Ethyl-4-methyl-2-pentanamine #AKOS000167342NSC 165672NSC-165672
Database identifiers
- CAS
42966-64-3、5171-66-4- PubChem CID
- 39359
- DTXSID
DTXSID20965980- Nikkaji
- J121.775E
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 59.6
Physicochemical properties
- Boiling point
- 136 °C · 136 °C
- Density
- 0.759 · 0.759±0.06 g/cm3(Predicted)
- pka
- 10.97 · 10.97±0.19(Predicted)
Related reactions
3 records
Compound notes
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