3-(4-ETHYLPHENYL)-2,2-DIMETHYLPROPANAL

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H18O
Molecular Weight	190.2814
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(4-ETHYLPHENYL)-2,2-DIMETHYLPROPANAL

Structure Search

SMILES

CCC1=CC=C(CC(C)(C)C=O)C=C1

InChI

InChIKey=JFTSYAALCNQOKO-UHFFFAOYSA-N

InChI=1S/C13H18O/c1-4-11-5-7-12(8-6-11)9-13(2,3)10-14/h5-8,10H,4,9H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C13H18O
Molecular Weight	190.2814
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:54:56 GMT 2023` Edited by `admin` on `Fri Dec 15 15:54:56 GMT 2023`
Record UNII	5V2FN5AA3W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-(4-ETHYLPHENYL)-2,2-DIMETHYLPROPANAL

Systematic Name

English

ETHYL 2,2-DIMETHYLHYDROCINNAMAL

Preferred Name

English

.ALPHA.,.ALPHA.-DIMETHYL-P-ETHYLPHENYLPROPANAL

Systematic Name

English

BENZENEPROPANAL, 4-ETHYL-.ALPHA.,.ALPHA.-DIMETHYL-

Systematic Name

English

SEAWIND ALDEHYDE E

Common Name

English

ETHYL DIMETHYL HYDROCINNAMALDEHYDE

Systematic Name

English

ETHYL 2,2-DIMETHYLHYDROCINNAMAL [INCI]

Common Name

English

Code System Code Type Description

RXCUI

1649018

Created by admin on Fri Dec 15 15:54:56 GMT 2023 , Edited by admin on Fri Dec 15 15:54:56 GMT 2023

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RxNorm

DAILYMED

5V2FN5AA3W

Created by admin on Fri Dec 15 15:54:56 GMT 2023 , Edited by admin on Fri Dec 15 15:54:56 GMT 2023

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FDA UNII

5V2FN5AA3W

Created by admin on Fri Dec 15 15:54:56 GMT 2023 , Edited by admin on Fri Dec 15 15:54:56 GMT 2023

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CAS

67634-15-5

Created by admin on Fri Dec 15 15:54:56 GMT 2023 , Edited by admin on Fri Dec 15 15:54:56 GMT 2023

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EPA CompTox

DTXSID3052359

Created by admin on Fri Dec 15 15:54:56 GMT 2023 , Edited by admin on Fri Dec 15 15:54:56 GMT 2023

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PUBCHEM

105513

Created by admin on Fri Dec 15 15:54:56 GMT 2023 , Edited by admin on Fri Dec 15 15:54:56 GMT 2023

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ECHA (EC/EINECS)

266-819-2

Created by admin on Fri Dec 15 15:54:56 GMT 2023 , Edited by admin on Fri Dec 15 15:54:56 GMT 2023

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