54576-36-2
BENZENE,1-METHYL-3-[(2-METHYLPROPYL)THIO]-
NameBENZENE,1-METHYL-3-[(2-METHYLPROPYL)THIO]-
1Identification
【Name】
BENZENE,1-METHYL-3-[(2-METHYLPROPYL)THIO]-
【CAS】
【MDL】
MFCD18971229
【English Synonyms】
【Formula】
C11 H16 S
【MolWeight】
180.313
【Inchi】
InChI=1S/C11H16S/c1-9(2)8-12-11-6-4-5-10(3)7-11/h4-7,9H,8H2,1-3H3
【InChIKey】
InChIKey=KRXIEQVZXKGPPE-UHFFFAOYSA-N
【SMILES】
Cc1cccc(c1)SCC(C)C
【MOL File】
BENZENE,1-METHYL-3-[….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BENZENE,1-METHYL-3-[(2-METHYLPROPYL)THIO]-.cml