4-METHOXY-2,3,6-TRIMETHYLBENZALDEHYDE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H14O2
Molecular Weight	178.2277
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-METHOXY-2,3,6-TRIMETHYLBENZALDEHYDE

Structure Search

SMILES

COC1=CC(C)=C(C=O)C(C)=C1C

InChI

InChIKey=BTOFIDLWQJCUJG-UHFFFAOYSA-N

InChI=1S/C11H14O2/c1-7-5-11(13-4)9(3)8(2)10(7)6-12/h5-6H,1-4H3

HIDE SMILES / InChI

Molecular Formula	C11H14O2
Molecular Weight	178.2277
Charge	0
Count

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

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:32:32 GMT 2025` Edited by `admin` on `Mon Mar 31 21:32:32 GMT 2025`
Record UNII	XA09SR3JI3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-METHOXY-2,3,6-TRIMETHYLBENZALDEHYDE

Preferred Name

English

Code System Code Type Description

CAS

54344-92-2

Created by admin on Mon Mar 31 21:32:32 GMT 2025 , Edited by admin on Mon Mar 31 21:32:32 GMT 2025

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EPA CompTox

DTXSID80202722

Created by admin on Mon Mar 31 21:32:32 GMT 2025 , Edited by admin on Mon Mar 31 21:32:32 GMT 2025

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FDA UNII

XA09SR3JI3

Created by admin on Mon Mar 31 21:32:32 GMT 2025 , Edited by admin on Mon Mar 31 21:32:32 GMT 2025

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PUBCHEM

824142

Created by admin on Mon Mar 31 21:32:32 GMT 2025 , Edited by admin on Mon Mar 31 21:32:32 GMT 2025

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ECHA (EC/EINECS)

259-117-2

Created by admin on Mon Mar 31 21:32:32 GMT 2025 , Edited by admin on Mon Mar 31 21:32:32 GMT 2025

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