923591-20-2
N-[[(2,2-DIMETHYL-5-HEXEN-1-YL)OXY]CARBONYL]-3-METHYL-L-VALINE
NameN-[[(2,2-DIMETHYL-5-HEXEN-1-YL)OXY]CARBONYL]-3-METHYL-L-VALINE
1Identification
【Name】
N-[[(2,2-DIMETHYL-5-HEXEN-1-YL)OXY]CARBONYL]-3-METHYL-L-VALINE
【CAS】
【MDL】
MFCD13193227
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C15 H27 N O4
【pro_molWeight】
285.381
【Inchi】
InChI=1S/C15H27NO4/c1-7-8-9-15(5,6)10-20-13(19)16-11(12(17)18)14(2,3)4/h7,11H,1,8-10H2,2-6H3,(H,16,19)(H,17,18)/t11-/m1/s1
【InChIKey】
InChIKey=SQRDVSLNJDVGSP-LLVKDONJSA-N
【SMILES】
CC(C)(C)[C@@H](C(=O)O)NC(=O)OCC(C)(C)CCC=C
【MOL File】
N-[[(2,2-DIMETHYL-5-….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:5
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
N-[[(2,2-DIMETHYL-5-HEXEN-1-YL)OXY]CARBONYL]-3-METHYL-L-VALINE.cml