939986-45-5
3-(6-CHLORO-PYRIMIDIN-4-YLOXYMETHYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
Name3-(6-CHLORO-PYRIMIDIN-4-YLOXYMETHYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
pro_formulaC15 H22 Cl N3 O3
1Identification
【Name】
3-(6-CHLORO-PYRIMIDIN-4-YLOXYMETHYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
【CAS】
【MDL】
MFCD09607597
【EnglishSynonyms】
【pro_formula】
C15 H22 Cl N3 O3
【pro_molWeight】
327.81
【Inchi】
InChI=1S/C15H22ClN3O3/c1-15(2,3)22-14(20)19-6-4-5-11(8-19)9-21-13-7-12(16)17-10-18-13/h7,10-11H,4-6,8-9H2,1-3H3
【InChIKey】
InChIKey=REVGNHNCFFLIKE-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)N1CCCC(C1)COc2cc(ncn2)Cl
【MOL File】
3-(6-CHLORO-PYRIMIDI….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:6
XLogP3:3.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
3-(6-CHLORO-PYRIMIDIN-4-YLOXYMETHYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER.cml