3,5-XYLYL CHLOROFORMATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H9ClO2
Molecular Weight	184.62
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,5-XYLYL CHLOROFORMATE

Structure Search

SMILES

CC1=CC(OC(Cl)=O)=CC(C)=C1

InChI

InChIKey=KLLAFPIQULNDBN-UHFFFAOYSA-N

InChI=1S/C9H9ClO2/c1-6-3-7(2)5-8(4-6)12-9(10)11/h3-5H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C9H9ClO2
Molecular Weight	184.62
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 12:37:05 GMT 2025` Edited by `admin` on `Wed Apr 02 12:37:05 GMT 2025`
Record UNII	Q9W6KDM9SL
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3,5-XYLYL CHLOROFORMATE

Systematic Name

English

3,5-DIMETHYLPHENYL CARBONOCHLORIDATE

Preferred Name

English

CARBONOCHLORIDIC ACID, 3,5-DIMETHYLPHENYL ESTER

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID10189597

Created by admin on Wed Apr 02 12:37:05 GMT 2025 , Edited by admin on Wed Apr 02 12:37:05 GMT 2025

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ECHA (EC/EINECS)

252-842-5

Created by admin on Wed Apr 02 12:37:05 GMT 2025 , Edited by admin on Wed Apr 02 12:37:05 GMT 2025

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FDA UNII

Q9W6KDM9SL

Created by admin on Wed Apr 02 12:37:05 GMT 2025 , Edited by admin on Wed Apr 02 12:37:05 GMT 2025

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PUBCHEM

22026189

Created by admin on Wed Apr 02 12:37:05 GMT 2025 , Edited by admin on Wed Apr 02 12:37:05 GMT 2025

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CAS

36037-36-2

Created by admin on Wed Apr 02 12:37:05 GMT 2025 , Edited by admin on Wed Apr 02 12:37:05 GMT 2025

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