Basic information
- CAS
15788-74-6- Standard SMILES
CC[NH+](CC)CCOC(=O)c1ccc(OCC(C)C)cc1.[Cl-]- InChIKey
IVBOXVYBNVDHKD-UHFFFAOYSA-N- Molecular formula
- C17H28ClNO3
- Average molar mass
- 329.9 g/mol
- Monoisotopic mass
- 329.1757714
Names & identifiers
- Preferred name
- Benzoic acid, p-isobutoxy-, 2-diethylaminoethyl ester, hydrochloride
- IUPAC
- diethyl-[2-[4-(2-methylpropoxy)benzoyl]oxyethyl]azanium chloride
Names & synonyms
BENZOIC ACID, p-ISOBUTOXY-, 2-DIETHYLAMINOETHYL ESTER, HYDROCHLORIDE15788-74-6RefChem:1079322p-Isobutoxybenzoic acid 2-diethylaminoethyl ester hydrochloride
Database identifiers
- CAS
15788-74-6- PubChem CID
- 27482
Properties
Computed structural properties
- Topological polar surface area
- 40 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 282
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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