3-CHLOROPROPIONIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C3H5ClO2
Molecular Weight	108.524
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-CHLOROPROPIONIC ACID

SMILES

OC(=O)CCCl

InChI

InChIKey=QEYMMOKECZBKAC-UHFFFAOYSA-N

InChI=1S/C3H5ClO2/c4-2-1-3(5)6/h1-2H2,(H,5,6)

HIDE SMILES / InChI

Molecular Formula	C3H5ClO2
Molecular Weight	108.524
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Show entries

Title	Date	PubMed
Synthesis of N4-(2-acetamido-2-deoxy-beta-D-glucopyranosyl)-L-asparagine analogues. n-Butyramide, 3-chloropropionamide, 3-aminopropionamide, and isovaleramide analogues.	2001 Apr 23	11398986
Fate and kinetics of carfentrazone-ethyl herbicide in California, USA, flooded rice fields.	2001 Mar	11349847
Enhancement of NGF- and cholera toxin-induced neurite outgrowth by butyrate in PC12 cells.	2002 Oct 4	12270499
3-chloropropanoic acid (UMB66): a ligand for the gamma-hydroxybutyric acid receptor lacking a 4-hydroxyl group.	2004 Apr 1	15028257
Development of a gas chromatographic test for the quantification of the biomarker 3-bromopropionic acid in human urine.	2004 Apr 5	15018799

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Patents

Substance Class	Chemical
Record UNII	R5J180FN9Z
Record Status	`Validated (UNII)`
Record Version

Show entries

Name

Type

Language

3-CHLOROPROPIONIC ACID

Systematic Name

English

3-CHLOROPROPANOIC ACID

Systematic Name

English

PROPANOIC ACID, 3-CHLORO-

Common Name

English

PROPIONIC ACID, 3-CHLORO-

Common Name

English

NSC-174

Code

English

Showing 1 to 5 of 8 entries

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Show entries

Code System

Code

Type

Description

WIKIPEDIA

3-Chloropropanoic acid

PRIMARY

CAS

107-94-8

PRIMARY

NSC

174

PRIMARY

FDA UNII

R5J180FN9Z

PRIMARY

EPA CompTox

DTXSID5021546

PRIMARY

Showing 1 to 5 of 9 entries

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