108830-84-8
p-[trans-4-(5-hexenyl)cyclohexyl]phenylisothiocyanate
Namep-[trans-4-(5-hexenyl)cyclohexyl]phenylisothiocyanate
1Identification
【Name】
p-[trans-4-(5-hexenyl)cyclohexyl]phenylisothiocyanate
【CAS】
【MDL】
【English Synonyms】
【Formula】
C19H25NS
【MolWeight】
299.474
【Inchi】
InChI=1S/C19H25NS/c1-2-3-4-5-6-16-7-9-17(10-8-16)18-11-13-19(14-12-18)20-15-21/h2,11-14,16-17H,1,3-10H2/t16-,17-
【InChIKey】
InChIKey=INZOPGRDJOPERT-QAQDUYKDSA-N
【SMILES】
C(CCCC=C)[C@@H]1CC[C@H](CC1)C1=CC=C(C=C1)N=C=S
【MOL File】
p-[trans-4-(5-hexeny….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
p-[trans-4-(5-hexenyl)cyclohexyl]phenylisothiocyanate.cml