2-Penten-1-amine, N,N,2-trimethyl-, (E)-
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Basic information
- CAS
55630-70-1- Standard SMILES
CC/C=C(\C)CN(C)C- InChIKey
SAKMMOBJLDZJHA-SOFGYWHQSA-N- Molecular formula
- C8H17N
- Average molar mass
- 127.23 g/mol
- Monoisotopic mass
- 127.13609955
Names & identifiers
- Preferred name
- 2-Penten-1-amine, N,N,2-trimethyl-, (E)-
- IUPAC
- (E)-N,N,2-trimethylpent-2-en-1-amine
- English name
- (E)-N,N,2-Trimethyl-2-penten-1-amine
- Molecular formula
- C8H17N
- Molecular weight
- 127.23
Names & synonyms
(E)-N,N,2-Trimethyl-2-penten-1-amine2-Penten-1-amine, N,N,2-trimethyl-, (E)-55630-70-1SCHEMBL5685996SAKMMOBJLDZJHA-SOFGYWHQSA-NDB-322060(2E)-N,N,2-Trimethyl-2-penten-1-amine #2-Penten-1-amine, N,N,2-trimethyl-, (E)- (9CI)
Database identifiers
- CAS
55630-70-1- PubChem CID
- 5365229
- Nikkaji
- J144.867F
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 92.7
Physicochemical properties
- Boiling point
- 76 °C · 76 °C(Press: 30 Torr)
- Density
- 0.788 · 0.788±0.06 g/cm3(Predicted)
- pka
- 9.39 · 9.39±0.28(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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