740817-73-6
BICYCLO[2.2.1]HEPTAN-2-OL, 1,3,3-TRIMETHYL-2-(2-PROPENYL)-, (1S,2R,4R)-
NameBICYCLO[2.2.1]HEPTAN-2-OL, 1,3,3-TRIMETHYL-2-(2-PROPENYL)-, (1S,2R,4R)-
1Identification
【Name】
BICYCLO[2.2.1]HEPTAN-2-OL, 1,3,3-TRIMETHYL-2-(2-PROPENYL)-, (1S,2R,4R)-
【CAS】
【MDL】
MFCD18833002
【English Synonyms】
【Formula】
C13 H22 O
【MolWeight】
194.316
【Inchi】
InChI=1S/C13H22O/c1-5-7-13(14)11(2,3)10-6-8-12(13,4)9-10/h5,10,14H,1,6-9H2,2-4H3/t10-,12+,13+/m1/s1
【InChIKey】
InChIKey=WGAXQSZECFSMJW-WXHSDQCUSA-N
【SMILES】
CC1([C@@H]2CC[C@@](C2)([C@@]1(CC=C)O)C)C
【MOL File】
BICYCLO[2.2.1]HEPTAN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:1
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BICYCLO[2.2.1]HEPTAN-2-OL, 1,3,3-TRIMETHYL-2-(2-PROPENYL)-, (1S,2R,4R)-.cml