3-(3-CHLOROPHENYL)-2-PROPYNOIC ACID

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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 3-(3-CHLOROPHENYL)-2-PROPYNOIC ACID

Structure Search

SMILES

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

InChI

InChIKey=FRTZPNZKFMZQDR-UHFFFAOYSA-N

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

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

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:20:07 GMT 2025` Edited by `admin` on `Mon Mar 31 22:20:07 GMT 2025`
Record UNII	2N265Q95PV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-408175

Preferred Name

English

3-(3-CHLOROPHENYL)-2-PROPYNOIC ACID

Systematic Name

English

3-(3-CHLOROPHENYL)-2-PROPYNOIC ACID [HSDB]

Common Name

English

PROPIOLIC ACID, (M-CHLOROPHENYL)-

Systematic Name

English

2-PROPYNOIC ACID, 3-(3-CHLOROPHENYL)-

Systematic Name

English

PROPYNOIC ACID, (3-CHLOROPHENYL)-

Systematic Name

English

3-(3-CHLOROPHENYL)PROPIOLIC ACID

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID90224692

Created by admin on Mon Mar 31 22:20:07 GMT 2025 , Edited by admin on Mon Mar 31 22:20:07 GMT 2025

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NSC

408175

Created by admin on Mon Mar 31 22:20:07 GMT 2025 , Edited by admin on Mon Mar 31 22:20:07 GMT 2025

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CAS

7396-28-3

Created by admin on Mon Mar 31 22:20:07 GMT 2025 , Edited by admin on Mon Mar 31 22:20:07 GMT 2025

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FDA UNII

2N265Q95PV

Created by admin on Mon Mar 31 22:20:07 GMT 2025 , Edited by admin on Mon Mar 31 22:20:07 GMT 2025

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HSDB

2674

Created by admin on Mon Mar 31 22:20:07 GMT 2025 , Edited by admin on Mon Mar 31 22:20:07 GMT 2025

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PUBCHEM

23879

Created by admin on Mon Mar 31 22:20:07 GMT 2025 , Edited by admin on Mon Mar 31 22:20:07 GMT 2025

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