2-Allyl-6-(dimethylamino)-3,4-hexadien-1-ol
Basic information
- CAS
79415-69-3- Standard SMILES
C=CCC(C=C=CCN(C)C)CO- InChIKey
VYFONFVXJTXMBP-UHFFFAOYSA-N- Molecular formula
- C11H19NO
- Average molar mass
- 181.27 g/mol
- Monoisotopic mass
- 181.14666423
Names & identifiers
- Preferred name
- 2-Allyl-6-(dimethylamino)-3,4-hexadien-1-ol
- IUPAC
- 6-(dimethylamino)-2-prop-2-enylhexa-3,4-dien-1-ol
Names & synonyms
79415-69-32-Allyl-6-(dimethylamino)-3,4-hexadien-1-olNSC355952NSC 355952DTXSID401000459NSC-3559522-allyl-6-(dimethylamino)hexa-3,4-dien-1-ol6-(Dimethylamino)-2-(prop-2-en-1-yl)hexa-3,4-dien-1-ol
Database identifiers
- CAS
79415-69-3- PubChem CID
- 337532
- DTXSID
DTXSID401000459
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 190
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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