54756-70-6
(E)-1-(4-METHOXY-2,3,6-TRIMETHYL-PHENYL)-3-METHYL-PENT-1-EN-4-YN-3-OL
Name
(E)-1-(4-METHOXY-2,3,6-TRIMETHYL-PHENYL)-3-METHYL-PENT-1-EN-4-YN-3-OL
pro_formula
C16 H20 O2
pro_molWeight
244.332
1Identification
【Name】
(E)-1-(4-METHOXY-2,3,6-TRIMETHYL-PHENYL)-3-METHYL-PENT-1-EN-4-YN-3-OL
【CAS】
【MDL】
MFCD09033281
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C16 H20 O2
【pro_molWeight】
244.332
【Inchi】
InChI=1S/C16H20O2/c1-7-16(5,17)9-8-14-11(2)10-15(18-6)13(4)12(14)3/h1,8-10,17H,2-6H3/b9-8+
【InChIKey】
InChIKey=LWTUOVCJGLKIJD-CMDGGOBGSA-N
【SMILES】
Cc1cc(c(c(c1/C=C/C(C)(C#C)O)C)C)OC
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:2
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
(E)-1-(4-METHOXY-2,3,6-TRIMETHYL-PHENYL)-3-METHYL-PENT-1-EN-4-YN-3-OL.cml
quick_release
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