Basic information
- CAS
2597-09-3- Standard SMILES
C=CCC(CC=C)(C(=O)OCCN(CC)CC)c1ccccc1- InChIKey
NSBJDSZHLUZFHI-UHFFFAOYSA-N- Molecular formula
- C20H29NO2
- Average molar mass
- 315.4 g/mol
- Monoisotopic mass
- 315.21982917
Overview
RN given refers to parent cpd; structure
Names & identifiers
- Preferred name
- Benzeneacetic acid, alpha,alpha-di-2-propen-1-yl-, 2-(diethylamino)ethyl ester
- IUPAC
- 2-(diethylamino)ethyl 2-phenyl-2-prop-2-enylpent-4-enoate
Names & synonyms
2-diethylaminoethyl Diallylphenylacetate2597-09-3alpha,alpha-Di-2-propenylbenzeneacetic acid, 2-(diethylamino)ethyl esterCFT-1201RefChem:916861Benzeneacetic acid, alpha,alpha-di-2-propen-1-yl-, 2-(diethylamino)ethyl esterCft 1201DTXSID409488712-(diethylamino)ethyl 2-phenyl-2-prop-2-enylpent-4-enoate2-Allyl-2-phenyl-4-pentenoic acid 2-(diethylamino)ethyl ester hydrochloride4-Pentenoic acid, 2-allyl-2-phenyl-, 2-(diethylamino)ethyl ester, hydrochlorideBenzeneacetic acid, alpha,alpha-di-2-propenyl-, 2-(diethylamino)ethyl ester hydrochloride
Show more names
Phenyldiallylessigsaure-diathylaminoathylester2-(Diethylamino)ethyl 2-phenyl-2-(prop-2-en-1-yl)pent-4-enoate
Database identifiers
- CAS
2597-09-3- PubChem CID
- 197002
- DTXSID
DTXSID40948871
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 12
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 358
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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