1240594-09-5
(5-FLUORO-4-HYDROXY-6-PHENYL-PYRIMIDIN-2-YLMETHYL)-CARBAMIC ACID TERT-BUTYL ESTER
Name(5-FLUORO-4-HYDROXY-6-PHENYL-PYRIMIDIN-2-YLMETHYL)-CARBAMIC ACID TERT-BUTYL ESTER
1Identification
【Name】
(5-FLUORO-4-HYDROXY-6-PHENYL-PYRIMIDIN-2-YLMETHYL)-CARBAMIC ACID TERT-BUTYL ESTER
【CAS】
【MDL】
MFCD16988095
【English Synonyms】
【Formula】
C16 H18 F N3 O3
【MolWeight】
319.334
【Inchi】
InChI=1S/C16H18FN3O3/c1-16(2,3)23-15(22)18-9-11-19-13(12(17)14(21)20-11)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H,18,22)(H,19,20,21)
【InChIKey】
InChIKey=DQUVEUSVIWUFBZ-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)NCc1nc(c(c(n1)O)F)c2ccccc2
【MOL File】
(5-FLUORO-4-HYDROXY-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(5-FLUORO-4-HYDROXY-6-PHENYL-PYRIMIDIN-2-YLMETHYL)-CARBAMIC ACID TERT-BUTYL ESTER.cml