2,4-Dodecadienoic acid, 11-methoxy-3,7,11-trimethyl-, ammonium salt (1:1), (2E,4E)-
Basic information
- CAS
53023-66-8- Standard SMILES
COC(C)(C)CCCC(C)C/C=C/C(C)=C/C(=O)O.N- InChIKey
KFZAVLNCYMLPJD-ORZLCKBQSA-N- Molecular formula
- C16H31NO3
- Average molar mass
- 285.42 g/mol
- Monoisotopic mass
- 285.23039385
Names & identifiers
- Preferred name
- 2,4-Dodecadienoic acid, 11-methoxy-3,7,11-trimethyl-, ammonium salt (1:1), (2E,4E)-
- IUPAC
- azane;(2E,4E)-11-methoxy-3,7,11-trimethyldodeca-2,4-dienoic acid
Names & synonyms
EINECS 258-306-72,4-Dodecadienoic acid, 11-methoxy-3,7,11-trimethyl-, ammonium salt (1:1), (2E,4E)-53023-66-8Ammonium (+-)-(2E,4E)-11-methoxy-3,7,11-trimethyl-2,4-dodecadienoate2,4-Dodecadienoic acid, 11-methoxy-3,7,11-trimethyl-, ammonium salt, (2E,4E)-Ammonium (2E,4E)-(1)-11-methoxy-3,7,11-trimethyldodeca-2,4-dienoateDTXSID201014951RefChem:82613DTXCID801473284KFZAVLNCYMLPJD-ORZLCKBQSA-N
Database identifiers
- CAS
53023-66-8- PubChem CID
- 6437014
- EC Number
- 258-306-7
Properties
Computed structural properties
- Topological polar surface area
- 47.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 327
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2,4-Dodecadienoic acid, 11-methoxy-3,7,11-trimethyl-, ammonium salt (1:1), (2E,4E)-: ACTIVE
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Compound notes
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