889948-10-1
[1-(4-AMINO-PHENYL)-AZETIDIN-3-YL]-CARBAMIC ACID TERT-BUTYL ESTER
Name[1-(4-AMINO-PHENYL)-AZETIDIN-3-YL]-CARBAMIC ACID TERT-BUTYL ESTER
1Identification
【Name】
[1-(4-AMINO-PHENYL)-AZETIDIN-3-YL]-CARBAMIC ACID TERT-BUTYL ESTER
【CAS】
【MDL】
MFCD06657372
【English Synonyms】
【Formula】
C14 H21 N3 O2
【MolWeight】
263.339
【Inchi】
InChI=1S/C14H21N3O2/c1-14(2,3)19-13(18)16-11-8-17(9-11)12-6-4-10(15)5-7-12/h4-7,11H,8-9,15H2,1-3H3,(H,16,18)
【InChIKey】
InChIKey=HVVRSUVDZYKWCV-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)NC1CN(C1)c2ccc(cc2)N
【MOL File】
[1-(4-AMINO-PHENYL)-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
[1-(4-AMINO-PHENYL)-AZETIDIN-3-YL]-CARBAMIC ACID TERT-BUTYL ESTER.cml