Methyl o-tolyl sulfide

Base Information

• Chemical Name: Methyl o-tolyl sulfide
• CAS No.: 26898-14-6
• Molecular Formula: C8H10S
• European Community (EC) Number: 679-018-1
• NSC Number: 90083
• DSSTox Substance ID: DTXSID10293502
• Nikkaji Number: J101.264I
• Wikidata: Q82032280
• Mol file: 26898-14-6.mol

Synonyms:14092-00-3;Methyl o-tolyl sulfide;methyl(o-tolyl)sulfane;2-methylthioanisole;1-methyl-2-methylsulfanylbenzene;1-Methyl-2-(methylsulfanyl)benzene;Benzene, 1-methyl-2-(methylthio)-;o-Cresyl methyl sulfide;Sulfide, methyl o-tolyl;2-Methyl-(1-thiaethyl)benzene;2-METHYLBENZYL MERCAPTAN, 97;methyl tolyl thioether;26898-14-6;2-(Methylthio)toluene;NCIOpen2_001459;SCHEMBL407202;1-methyl-2-(methylthio)benzene;2-Methylbenzenethiol, S-methyl-;BHWJMPDCCDMCKC-UHFFFAOYSA-;DTXSID10293502;NSC90083;NSC-90083;1-Methyl-2-(methylsulfanyl)benzene #;AKOS006239018;CS-0309255;FT-0613013;FT-0613018;EN300-1710182;A807707;2-Methylbenzylmercaptan, (2-Methyl-a-toluenethiol);Z785054008;InChI=1/C8H10S/c1-7-5-3-4-6-8(7)9-2/h3-6H,1-2H3

Chemical Property of Methyl o-tolyl sulfide

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 138.05032149
• Heavy Atom Count: 9
• Complexity: 80.6

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1SC