506437-75-8
(1S,3R)-1-ETHYNYL-3-METHYLCYCLOHEXAN-1-OL
Name(1S,3R)-1-ETHYNYL-3-METHYLCYCLOHEXAN-1-OL
1Identification
【Name】
(1S,3R)-1-ETHYNYL-3-METHYLCYCLOHEXAN-1-OL
【CAS】
【MDL】
MFCD18827966
【English Synonyms】
【Formula】
C9 H14 O
【MolWeight】
138.209
【Inchi】
InChI=1S/C9H14O/c1-3-9(10)6-4-5-8(2)7-9/h1,8,10H,4-7H2,2H3/t8-,9+/m1/s1
【InChIKey】
InChIKey=YXHKSLYHWCBOIN-BDAKNGLRSA-N
【SMILES】
C[C@@H]1CCC[C@](C1)(C#C)O
【MOL File】
(1S,3R)-1-ETHYNYL-3-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:1
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(1S,3R)-1-ETHYNYL-3-METHYLCYCLOHEXAN-1-OL.cml