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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

SMILES

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

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:50:16 GMT 2023
Edited
by admin
on Sat Dec 16 08:50:16 GMT 2023
Record UNII
2N265Q95PV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(3-CHLOROPHENYL)-2-PROPYNOIC ACID
HSDB  
Systematic Name English
3-(3-CHLOROPHENYL)-2-PROPYNOIC ACID [HSDB]
Common Name English
PROPIOLIC ACID, (M-CHLOROPHENYL)-
Systematic Name English
NSC-408175
Code 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 Sat Dec 16 08:50:16 GMT 2023 , Edited by admin on Sat Dec 16 08:50:16 GMT 2023
PRIMARY
NSC
408175
Created by admin on Sat Dec 16 08:50:16 GMT 2023 , Edited by admin on Sat Dec 16 08:50:16 GMT 2023
PRIMARY
CAS
7396-28-3
Created by admin on Sat Dec 16 08:50:16 GMT 2023 , Edited by admin on Sat Dec 16 08:50:16 GMT 2023
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FDA UNII
2N265Q95PV
Created by admin on Sat Dec 16 08:50:16 GMT 2023 , Edited by admin on Sat Dec 16 08:50:16 GMT 2023
PRIMARY
HSDB
2674
Created by admin on Sat Dec 16 08:50:16 GMT 2023 , Edited by admin on Sat Dec 16 08:50:16 GMT 2023
PRIMARY
PUBCHEM
23879
Created by admin on Sat Dec 16 08:50:16 GMT 2023 , Edited by admin on Sat Dec 16 08:50:16 GMT 2023
PRIMARY