2-(2-(Diethylamino)ethoxy)-3-(2-propen-1-yl)benzaldehyde

HCID 56566

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Basic information

CAS: 93148-15-3
Standard SMILES: C=CCc1cccc(C=O)c1OCCN(CC)CC
InChIKey: VZEZONWRBFJJMZ-UHFFFAOYSA-N
Molecular formula: C16H23NO2
Average molar mass: 261.36 g/mol
Monoisotopic mass: 261.17287898

Overview

3-allyl-2-[2-(diethylamino)ethoxy]benzaldehyde is a member of the class of benzaldehydes carrying 2-(diethylamino)ethoxy and allyl substituents at positions 2 and 3 respectively. It is a member of benzaldehydes, an aromatic ether, a tertiary amino compound and an olefinic compound.

Names & identifiers

Preferred name: 2-(2-(Diethylamino)ethoxy)-3-(2-propen-1-yl)benzaldehyde
IUPAC: 2-[2-(diethylamino)ethoxy]-3-prop-2-enylbenzaldehyde

Names & synonyms

93148-15-32-beta-Diethylaminoethoxy-3-allyl-benzaldehydeBENZALDEHYDE, 3-ALLYL-2-(2-(DIETHYLAMINO)ETHOXY)-DTXSID20239299RefChem:1060820DTXCID901617902-(2-(Diethylamino)ethoxy)-3-(2-propen-1-yl)benzaldehyde3-allyl-2-[2-(diethylamino)ethoxy]benzaldehyde3-Allyl-2-(2-(diethylamino)ethoxy)benzaldehyde2-[2-(diethylamino)ethoxy]-3-prop-2-enylbenzaldehyde2-[2-(diethylamino)ethoxy]-3-(prop-2-en-1-yl)benzaldehydeBRN 3332352

Show more names

3-08-00-00819 (Beilstein Handbook Reference)SCHEMBL16295860SCHEMBL29407161CHEBI:86195Q27158975

Database identifiers

CAS: 93148-15-3
PubChem CID: 56566
DTXSID: DTXSID20239299
ChEBI: CHEBI:86195

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 29.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 9
Heavy atoms: 19
Formal charge: 0
Complexity: 263

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Compound notes

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