5-METHYL-2-THIOPHENECARBOXALDEHYDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H6OS
Molecular Weight	126.176
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-METHYL-2-THIOPHENECARBOXALDEHYDE

Structure Search

SMILES

CC1=CC=C(S1)C=O

InChI

InChIKey=VAUMDUIUEPIGHM-UHFFFAOYSA-N

InChI=1S/C6H6OS/c1-5-2-3-6(4-7)8-5/h2-4H,1H3

HIDE SMILES / InChI

Molecular Formula	C6H6OS
Molecular Weight	126.176
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
Prediction of genotoxicity of chemical compounds by statistical learning methods.	2005 Jun	15962942
2-Methyl-3-(5-methyl-2-thien-yl)-5-phenyl-perhydro-pyrrolo[3,4-d]isoxazole-4,6-dione.	2009 Mar 25	21582577

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:29:50 GMT 2023` Edited by `admin` on `Fri Dec 15 18:29:50 GMT 2023`
Record UNII	UDF14S002L
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

5-METHYL-2-THIOPHENECARBOXALDEHYDE

Systematic Name

English

FEMA NO. 3209

Code

English

2-THIOPHENECARBOXALDEHYDE, 5-METHYL-

Systematic Name

English

2-METHYLTHIOPHENE-5-CARBOXALDEHYDE

Systematic Name

English

2-FORMYL-5-METHYLTHIOPHENE

Systematic Name

English

NSC-87542

Code

English

5-METHYLTHIOPHENE-2-CARBALDEHYDE

Systematic Name

English

5-METHYL-2-THIENYLCARBALDEHYDE

Common Name

English

2-METHYL-5-FORMYLTHIOPHENE

Systematic Name

English

BREAD THIOPHENE

Common Name

English

Code System Code Type Description

NSC

87542