590353-07-4
5-(2-CYCLOHEXYLETHYL)-4-ETHYL-4H-1,2,4-TRIAZOLE-3-THIOL
Name5-(2-CYCLOHEXYLETHYL)-4-ETHYL-4H-1,2,4-TRIAZOLE-3-THIOL
1Identification
【Name】
5-(2-CYCLOHEXYLETHYL)-4-ETHYL-4H-1,2,4-TRIAZOLE-3-THIOL
【CAS】
【MDL】
MFCD03945669
【English Synonyms】
【Formula】
C12 H21 N3 S
【MolWeight】
239.385
【Inchi】
InChI=1S/C12H21N3S/c1-2-15-11(13-14-12(15)16)9-8-10-6-4-3-5-7-10/h10H,2-9H2,1H3,(H,14,16)
【InChIKey】
InChIKey=SHDJEDZJMWZKNV-UHFFFAOYSA-N
【SMILES】
CCn1c(nnc1S)CCC2CCCCC2
【MOL File】
5-(2-CYCLOHEXYLETHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-(2-CYCLOHEXYLETHYL)-4-ETHYL-4H-1,2,4-TRIAZOLE-3-THIOL.cml