2-THIOPHENECARBOXYLIC ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H4O2S
Molecular Weight	128.149
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

SMILES

OC(=O)C1=CC=CS1

InChI

InChIKey=QERYCTSHXKAMIS-UHFFFAOYSA-N

InChI=1S/C5H4O2S/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)

HIDE SMILES / InChI

Molecular Formula	C5H4O2S
Molecular Weight	128.149
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
Nonbasic, room temperature, palladium-catalyzed coupling of aryl and alkenyl iodides with boronic acids mediated by copper(I) thiophene-2-carboxylate (CuTC).	2001 Jul 12	11440566
Efficient cyclotrimerization of bicyclic vic-bromostannylalkenes promoted by copper(I) thiophen-2-carboxylate.	2002 Nov 1	12398524
Transition metal complexes of phenanthrenequinone thiosemicarbazone as potential anticancer agents: synthesis, structure, spectroscopy, electrochemistry and in vitro anticancer activity against human breast cancer cell-line, T47D.	2003 Jul 1	12818801
Prediction of genotoxicity of chemical compounds by statistical learning methods.	2005 Jun	15962942
Rhenium(V) complexes with thiolato and dithiolato ligands: synthesis, structures, and monomerization reactions.	2005 May 16	15877453

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Patents

Substance Class	Chemical
Record UNII	3FD00JX53J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-THIOPHENECARBOXYLIC ACID

Systematic Name

English

THENOIC ACID

Preferred Name

English

2-THENOIC ACID

Systematic Name

English

2-THIOPHENECARBOXYLIC ACID [MI]

Common Name

English

2-CARBOXYTHIOPHENE

Systematic Name

English

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Code System

Code

Type

Description

EPA CompTox

DTXSID2060177

PRIMARY

ECHA (EC/EINECS)

208-423-4

PRIMARY

SMS_ID

100000077794

PRIMARY

FDA UNII

3FD00JX53J

PRIMARY

MERCK INDEX

m10777

PRIMARY

Merck Index

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Related Record

Type

Details


					BP5T68675U

Sodium 2-thiophenecarboxylate

SALT/SOLVATE -> PARENT

Amount:

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