533939-49-0
2-THIOPHENEACETONITRILE, 4-(HYDROXYMETHYL)-
Name2-THIOPHENEACETONITRILE, 4-(HYDROXYMETHYL)-
1Identification
【Name】
2-THIOPHENEACETONITRILE, 4-(HYDROXYMETHYL)-
【CAS】
【MDL】
MFCD18817080
【English Synonyms】
【Formula】
C7 H7 N O S
【MolWeight】
153.204
【Inchi】
InChI=1S/C7H7NOS/c8-2-1-7-3-6(4-9)5-10-7/h3,5,9H,1,4H2
【InChIKey】
InChIKey=OEQJEAHLCYPCHI-UHFFFAOYSA-N
【SMILES】
c1c(csc1CC#N)CO
【MOL File】
2-THIOPHENEACETONITR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-THIOPHENEACETONITRILE, 4-(HYDROXYMETHYL)-.cml