1-Naphthaleneacetic acid, alpha-(3-(diethylamino)propyl)-alpha-isopropyl-, ethyl ester
Basic information
- CAS
6779-89-1- Standard SMILES
CCOC(=O)C(CCCN(CC)CC)(c1cccc2ccccc12)C(C)C- InChIKey
OFLQEJPQHBAJOE-UHFFFAOYSA-N- Molecular formula
- C24H35NO2
- Average molar mass
- 369.5 g/mol
- Monoisotopic mass
- 369.26677936
Names & identifiers
- Preferred name
- 1-Naphthaleneacetic acid, alpha-(3-(diethylamino)propyl)-alpha-isopropyl-, ethyl ester
- IUPAC
- ethyl 5-(diethylamino)-2-naphthalen-1-yl-2-propan-2-ylpentanoate
- English name
- α-[3-(Diethylamino)propyl]-α-(1-methylethyl)-1-naphthaleneacetic acid ethyl ester
- Molecular formula
- C24H35NO2
- Molecular weight
- 369.54
Names & synonyms
6779-89-11-Naphthaleneacetic acid, alpha-(3-(diethylamino)propyl)-alpha-isopropyl-, ethyl esterRefChem:1055941BRN 2773319alpha-(3-(Diethylamino)propyl)-alpha-isopropyl-1-naphthaleneacetic acid ethyl esterDTXSID20987127Ethyl 5-(diethylamino)-2-(naphthalen-1-yl)-2-(propan-2-yl)pentanoateα-[3-(Diethylamino)propyl]-α-(1-methylethyl)-1-naphthaleneacetic acid ethyl ester1-Naphthaleneacetic acid, α-[3-(diethylamino)propyl]-α-(1-methylethyl)-, ethyl ester
Database identifiers
- CAS
6779-89-1- PubChem CID
- 23227
- DTXSID
DTXSID20987127- Nikkaji
- J42.384J
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 446
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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