5684-35-5
1-(2-METHYL-1,3-OXATHIOLAN-2-YL)ETHANE-1-THIOL
Name1-(2-METHYL-1,3-OXATHIOLAN-2-YL)ETHANE-1-THIOL
1Identification
【Name】
1-(2-METHYL-1,3-OXATHIOLAN-2-YL)ETHANE-1-THIOL
【CAS】
【MDL】
MFCD16876328
【English Synonyms】
【Formula】
C6 H12 O S2
【MolWeight】
164.292
【Inchi】
InChI=1S/C6H12OS2/c1-5(8)6(2)7-3-4-9-6/h5,8H,3-4H2,1-2H3
【InChIKey】
InChIKey=ZQNGQLUZBMFGGK-UHFFFAOYSA-N
【SMILES】
CC(C1(OCCS1)C)S
【MOL File】
1-(2-METHYL-1,3-OXAT….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-METHYL-1,3-OXATHIOLAN-2-YL)ETHANE-1-THIOL.cml