2-(Diethylamino)ethyl 2-cyclohexyl-3-hydroxynonanoate--hydrogen chloride (1/1)
Basic information
- CAS
95008-07-4- Standard SMILES
CCCCCCC(O)C(C(=O)OCC[NH+](CC)CC)C1CCCCC1.[Cl-]- InChIKey
HCKUQDBBXSCFNV-UHFFFAOYSA-N- Molecular formula
- C21H42ClNO3
- Average molar mass
- 392 g/mol
- Monoisotopic mass
- 391.2853219
Names & identifiers
- Preferred name
- 2-(Diethylamino)ethyl 2-cyclohexyl-3-hydroxynonanoate--hydrogen chloride (1/1)
- IUPAC
- 2-(2-cyclohexyl-3-hydroxynonanoyl)oxyethyl-diethylazanium chloride
Names & synonyms
95008-07-4DTXSID009151802-(Diethylamino)ethyl 2-cyclohexyl-3-hydroxynonanoate--hydrogen chloride (1/1)RefChem:1061650DTXCID3013441592-Cyclohexyl-3-hydroxynonanoic acid 2-(diethylamino)ethyl ester hydrochloride2-(2-cyclohexyl-3-hydroxynonanoyl)oxyethyl-diethylazanium chlorideNonanoic acid, 2-cyclohexyl-3-hydroxy-, 2-(diethylamino)ethyl ester, hydrochloride2-Cyclohexyl-3-hydroxynonanoic acid 2-(diethylamino)ethyl ester hydrochloride, Nonanoic acid, 2-cyclohexyl-3-hydroxy-, 2-(diethylamino)ethyl ester, hydrochloride, AC1L1LT4, LS-96873, 2-(2-cyclohexyl-3-hydroxynonanoyl)oxyethyl-diethylazanium chloride, 95008-07-4
Database identifiers
- CAS
95008-07-4- PubChem CID
- 56849
Properties
Computed structural properties
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 14
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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