Basic information
- CAS
24589-39-7- Standard SMILES
CCCCC(C)(CC)C(=O)OCC[NH+](CC)CC.[Cl-]- InChIKey
BQPYXVZCRYSFHN-UHFFFAOYSA-N- Molecular formula
- C15H32ClNO2
- Average molar mass
- 293.87 g/mol
- Monoisotopic mass
- 293.212157
Names & identifiers
- Preferred name
- 2-(Diethylamino)ethyl 2-ethyl-2-methylhexanoate--hydrogen chloride (1/1)
- IUPAC
- diethyl-[2-(2-ethyl-2-methylhexanoyl)oxyethyl]azanium chloride
Names & synonyms
24589-39-7DTXSID909474702-(Diethylamino)ethyl 2-ethyl-2-methylhexanoate--hydrogen chloride (1/1)RefChem:1061653DTXCID1013757282-Ethyl-2-methylhexanoic acid 2-(diethylamino)ethyl ester hydrochlorideHEXANOIC ACID, 2-ETHYL-2-METHYL-, 2-(DIETHYLAMINO)ETHYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
24589-39-7- PubChem CID
- 32506
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 227
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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