939986-08-0
[1-(6-CHLORO-PYRIDAZIN-3-YL)-PIPERIDIN-3-YL]-CARBAMIC ACID TERT-BUTYL ESTER
Name[1-(6-CHLORO-PYRIDAZIN-3-YL)-PIPERIDIN-3-YL]-CARBAMIC ACID TERT-BUTYL ESTER
1Identification
【Name】
[1-(6-CHLORO-PYRIDAZIN-3-YL)-PIPERIDIN-3-YL]-CARBAMIC ACID TERT-BUTYL ESTER
【CAS】
【MDL】
MFCD09607517
【English Synonyms】
【Formula】
C14 H21 Cl N4 O2
【MolWeight】
312.799
【Inchi】
InChI=1S/C14H21ClN4O2/c1-14(2,3)21-13(20)16-10-5-4-8-19(9-10)12-7-6-11(15)17-18-12/h6-7,10H,4-5,8-9H2,1-3H3,(H,16,20)
【InChIKey】
InChIKey=STBYZIXCPVUJTQ-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)NC1CCCN(C1)c2ccc(nn2)Cl
【MOL File】
[1-(6-CHLORO-PYRIDAZ….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
[1-(6-CHLORO-PYRIDAZIN-3-YL)-PIPERIDIN-3-YL]-CARBAMIC ACID TERT-BUTYL ESTER.cml