METHYL 3-CHLORO-2,5-DIMETHYL-6-HYDROXY-P-ANISATE

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H13ClO4
Molecular Weight	244.672
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of METHYL 3-CHLORO-2,5-DIMETHYL-6-HYDROXY-P-ANISATE

Structure Search

SMILES

COC(=O)C1=C(C)C(Cl)=C(OC)C(C)=C1O

InChI

InChIKey=ALHKAHMAUJFZGF-UHFFFAOYSA-N

InChI=1S/C11H13ClO4/c1-5-7(11(14)16-4)9(13)6(2)10(15-3)8(5)12/h13H,1-4H3

HIDE SMILES / InChI

Molecular Formula	C11H13ClO4
Molecular Weight	244.672
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 `Wed Apr 02 12:34:03 GMT 2025` Edited by `admin` on `Wed Apr 02 12:34:03 GMT 2025`
Record UNII	XLB6Y9C47T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

METHYL 3-CHLORO-2,5-DIMETHYL-6-HYDROXY-P-ANISATE

Common Name

English

BENZOIC ACID, 3-CHLORO-6-HYDROXY-4-METHOXY-2,5-DIMETHYL-, METHYL ESTER

Preferred Name

English

METHYL 3-CHLORO-6-HYDROXY-4-METHOXY-2,5-DIMETHYLBENZOATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

56842385

Created by admin on Wed Apr 02 12:34:03 GMT 2025 , Edited by admin on Wed Apr 02 12:34:03 GMT 2025

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FDA UNII

XLB6Y9C47T

Created by admin on Wed Apr 02 12:34:03 GMT 2025 , Edited by admin on Wed Apr 02 12:34:03 GMT 2025

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EPA CompTox

DTXSID00234202

Created by admin on Wed Apr 02 12:34:03 GMT 2025 , Edited by admin on Wed Apr 02 12:34:03 GMT 2025

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ECHA (EC/EINECS)

285-447-1

Created by admin on Wed Apr 02 12:34:03 GMT 2025 , Edited by admin on Wed Apr 02 12:34:03 GMT 2025

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CAS

85098-93-7

Created by admin on Wed Apr 02 12:34:03 GMT 2025 , Edited by admin on Wed Apr 02 12:34:03 GMT 2025

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