2,3,6-TRIMETHOXYBENZALDEHYDE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H12O4
Molecular Weight	196.1999
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,3,6-TRIMETHOXYBENZALDEHYDE

Structure Search

SMILES

COC1=C(OC)C(C=O)=C(OC)C=C1

InChI

InChIKey=APHLYZNGFCQHCT-UHFFFAOYSA-N

InChI=1S/C10H12O4/c1-12-8-4-5-9(13-2)10(14-3)7(8)6-11/h4-6H,1-3H3

HIDE SMILES / InChI

Molecular Formula	C10H12O4
Molecular Weight	196.1999
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 `Tue Apr 01 17:41:26 GMT 2025` Edited by `admin` on `Tue Apr 01 17:41:26 GMT 2025`
Record UNII	DD5LX99GGR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,3,6-TRIMETHOXYBENZALDEHYDE

Preferred Name

English

Code System Code Type Description

PUBCHEM

79675

Created by admin on Tue Apr 01 17:41:26 GMT 2025 , Edited by admin on Tue Apr 01 17:41:26 GMT 2025

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ECHA (EC/EINECS)

226-918-3

Created by admin on Tue Apr 01 17:41:26 GMT 2025 , Edited by admin on Tue Apr 01 17:41:26 GMT 2025

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EPA CompTox

DTXSID90204116

Created by admin on Tue Apr 01 17:41:26 GMT 2025 , Edited by admin on Tue Apr 01 17:41:26 GMT 2025

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FDA UNII

DD5LX99GGR

Created by admin on Tue Apr 01 17:41:26 GMT 2025 , Edited by admin on Tue Apr 01 17:41:26 GMT 2025

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CAS

5556-86-5

Created by admin on Tue Apr 01 17:41:26 GMT 2025 , Edited by admin on Tue Apr 01 17:41:26 GMT 2025

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