81327-39-1
4-OXAZOLECARBOXYLIC ACID, 5-[(1S)-1-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-2-PHENYLETHYL]-, METHYL ESTER
Name4-OXAZOLECARBOXYLIC ACID, 5-[(1S)-1-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-2-PHENYLETHYL]-, METHYL ESTER
1Identification
【Name】
4-OXAZOLECARBOXYLIC ACID, 5-[(1S)-1-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-2-PHENYLETHYL]-, METHYL ESTER
【CAS】
【MDL】
MFCD17170148
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C18 H22 N2 O5
【pro_molWeight】
346.381
【Inchi】
InChI=1S/C18H22N2O5/c1-18(2,3)25-17(22)20-13(10-12-8-6-5-7-9-12)15-14(16(21)23-4)19-11-24-15/h5-9,11,13H,10H2,1-4H3,(H,20,22)/t13-/m0/s1
【InChIKey】
InChIKey=IYUCGGPSRZIGJP-ZDUSSCGKSA-N
【SMILES】
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)c2c(nco2)C(=O)OC
【MOL File】
4-OXAZOLECARBOXYLIC ….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:7
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4-OXAZOLECARBOXYLIC ACID, 5-[(1S)-1-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-2-PHENYLETHYL]-, METHYL ESTER.cml