864539-94-6
[2-HYDROXY-2-(4-TRIFLUOROMETHYL-PHENYL)-ETHYL]-CARBAMIC ACID TERT-BUTYL ESTER
Name[2-HYDROXY-2-(4-TRIFLUOROMETHYL-PHENYL)-ETHYL]-CARBAMIC ACID TERT-BUTYL ESTER
1Identification
【Name】
[2-HYDROXY-2-(4-TRIFLUOROMETHYL-PHENYL)-ETHYL]-CARBAMIC ACID TERT-BUTYL ESTER
【CAS】
【MDL】
MFCD08544102
【English Synonyms】
【Formula】
C14 H18 F3 N O3
【MolWeight】
305.294
【Inchi】
InChI=1S/C14H18F3NO3/c1-13(2,3)21-12(20)18-8-11(19)9-4-6-10(7-5-9)14(15,16)17/h4-7,11,19H,8H2,1-3H3,(H,18,20)
【InChIKey】
InChIKey=QRVMLXMOYYJIEC-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)NCC(c1ccc(cc1)C(F)(F)F)O
【MOL File】
[2-HYDROXY-2-(4-TRIF….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
[2-HYDROXY-2-(4-TRIFLUOROMETHYL-PHENYL)-ETHYL]-CARBAMIC ACID TERT-BUTYL ESTER.cml