6-Chlorocoumarin

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H5ClO2
Molecular Weight	180.588
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 6-Chlorocoumarin

Structure Search

SMILES

ClC1=CC=C2OC(=O)C=CC2=C1

InChI

InChIKey=AMQSYJCKXPUEDR-UHFFFAOYSA-N

InChI=1S/C9H5ClO2/c10-7-2-3-8-6(5-7)1-4-9(11)12-8/h1-5H

HIDE SMILES / InChI

Molecular Formula	C9H5ClO2
Molecular Weight	180.588
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 20:02:18 GMT 2025` Edited by `admin` on `Tue Apr 01 20:02:18 GMT 2025`
Record UNII	246B637U2Z
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-4140

Preferred Name

English

6-Chlorocoumarin

Systematic Name

English

Coumarin, 6-chloro-

Systematic Name

English

AI3-03685

Code

English

6-Chloro-2H-1-benzopyran-2-one

Systematic Name

English

2H-1-Benzopyran-2-one, 6-chloro-

Systematic Name

English

Code System Code Type Description

NSC

4140

Created by admin on Tue Apr 01 20:02:18 GMT 2025 , Edited by admin on Tue Apr 01 20:02:18 GMT 2025

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PUBCHEM

16321

Created by admin on Tue Apr 01 20:02:18 GMT 2025 , Edited by admin on Tue Apr 01 20:02:18 GMT 2025

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FDA UNII

246B637U2Z

Created by admin on Tue Apr 01 20:02:18 GMT 2025 , Edited by admin on Tue Apr 01 20:02:18 GMT 2025

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CAS

2051-59-4

Created by admin on Tue Apr 01 20:02:18 GMT 2025 , Edited by admin on Tue Apr 01 20:02:18 GMT 2025

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EPA CompTox

DTXSID30870930

Created by admin on Tue Apr 01 20:02:18 GMT 2025 , Edited by admin on Tue Apr 01 20:02:18 GMT 2025

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