2-(Diethylamino)ethyl cycloheptyl(1-hydroxycyclohexyl)acetate--hydrogen chloride (1/1)
Basic information
- CAS
95135-77-6- Standard SMILES
CC[NH+](CC)CCOC(=O)C(C1CCCCCC1)C1(O)CCCCC1.[Cl-]- InChIKey
VPXMTVXHZSAKBD-UHFFFAOYSA-N- Molecular formula
- C21H40ClNO3
- Average molar mass
- 390 g/mol
- Monoisotopic mass
- 389.2696718
Names & identifiers
- Preferred name
- 2-(Diethylamino)ethyl cycloheptyl(1-hydroxycyclohexyl)acetate--hydrogen chloride (1/1)
- IUPAC
- 2-[2-cycloheptyl-2-(1-hydroxycyclohexyl)acetyl]oxyethyl-diethylazanium chloride
Names & synonyms
95135-77-6DTXSID309150972-(Diethylamino)ethyl cycloheptyl(1-hydroxycyclohexyl)acetate--hydrogen chloride (1/1)RefChem:1061701DTXCID001344079alpha-Cyclohexyl-1-hydroxycycloheptaneacetic acid 2-(diethylamino)ethyl ester hydrochlorideCycloheptaneacetic acid, alpha-cyclohexyl-1-hydroxy-, 2-(diethylamino)ethyl ester, hydrochloride
Database identifiers
- CAS
95135-77-6- PubChem CID
- 56868
Properties
Computed structural properties
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 381
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…