916423-36-4
1,3-PIPERIDINEDICARBOXYLIC ACID, 4-(4-METHYLPHENYL)-, 1-(1,1-DIMETHYLETHYL) ESTER
Name1,3-PIPERIDINEDICARBOXYLIC ACID, 4-(4-METHYLPHENYL)-, 1-(1,1-DIMETHYLETHYL) ESTER
1Identification
【Name】
1,3-PIPERIDINEDICARBOXYLIC ACID, 4-(4-METHYLPHENYL)-, 1-(1,1-DIMETHYLETHYL) ESTER
【CAS】
【MDL】
MFCD08751811
【EnglishSynonyms】
【pro_formula】
C18 H25 N O4
【pro_molWeight】
319.398
【Inchi】
InChI=1S/C18H25NO4/c1-12-5-7-13(8-6-12)14-9-10-19(11-15(14)16(20)21)17(22)23-18(2,3)4/h5-8,14-15H,9-11H2,1-4H3,(H,20,21)
【InChIKey】
InChIKey=LOODRMAUCBUUCH-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)C2CCN(CC2C(=O)O)C(=O)OC(C)(C)C
【MOL File】
1,3-PIPERIDINEDICARB….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:5
XLogP3:4.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
1,3-PIPERIDINEDICARBOXYLIC ACID, 4-(4-METHYLPHENYL)-, 1-(1,1-DIMETHYLETHYL) ESTER.cml