4-(METHYLTHIO)BENZALDEHYDE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H8OS
Molecular Weight	152.214
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(METHYLTHIO)BENZALDEHYDE

SMILES

CSC1=CC=C(C=O)C=C1

InChI

InChIKey=QRVYABWJVXXOTN-UHFFFAOYSA-N

InChI=1S/C8H8OS/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H3

HIDE SMILES / InChI

Molecular Formula	C8H8OS
Molecular Weight	152.214
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
4-[4-(Methyl-sulfan-yl)phen-yl]-6-phenyl-2,2'-bipyridine.	2007 Dec 18	21200844
(E)-5-(3,5-Dimethyl-phen-yl)-N-[4-(methyl-sulfan-yl)benzyl-idene]-1,3,4-thia-diazol-2-amine.	2010 Jan 20	21579829
(E)-N'-[4-(Methyl-sulfan-yl)benzyl-idene]furan-2-carbohydrazide monohydrate.	2010 Jul 31	21588441
4-Ethyl-1-[4-(methyl-sulfan-yl)benzyl-idene]thio-semicarbazide.	2010 Jun 18	21587932

Showing 1 to 4 of 4 entries

Patents

Substance Class	Chemical
Record UNII	1TVQ11BIY8
Record Status	`Validated (UNII)`
Record Version

Show entries

Name

Type

Language

4-(METHYLTHIO)BENZALDEHYDE

Systematic Name

English

BENZALDEHYDE, P-(METHYLTHIO)-

Preferred Name

English

BENZALDEHYDE, 4-(METHYLTHIO)-

Systematic Name

English

P-(METHYLTHIO)BENZALDEHYDE

Common Name

English

4-(METHYLMERCAPTO)BENZALDEHYDE

Systematic Name

English

Showing 1 to 5 of 10 entries

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Show entries

Code System

Code

Type

Description

EPA CompTox

DTXSID0033047

PRIMARY

PUBCHEM

76985

PRIMARY

CAS

3446-89-7

PRIMARY

FDA UNII

1TVQ11BIY8

PRIMARY

ECHA (EC/EINECS)

222-365-7

PRIMARY

Showing 1 to 5 of 5 entries