220077-24-7
(5S)-N-(TERT-BUTOXYCARBONYL)-3,4,5,6-TETRAHYDRO-5-PHENYL-4(H)-1,4-OXAZIN-2-ONE
Name(5S)-N-(TERT-BUTOXYCARBONYL)-3,4,5,6-TETRAHYDRO-5-PHENYL-4(H)-1,4-OXAZIN-2-ONE
1Identification
【Name】
(5S)-N-(TERT-BUTOXYCARBONYL)-3,4,5,6-TETRAHYDRO-5-PHENYL-4(H)-1,4-OXAZIN-2-ONE
【CAS】
【MDL】
MFCD02684331
【English Synonyms】
【Formula】
C15 H19 N O4
【MolWeight】
277.318
【Inchi】
InChI=1S/C15H19NO4/c1-15(2,3)20-14(18)16-9-13(17)19-10-12(16)11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3/t12-/m1/s1
【InChIKey】
InChIKey=CZACTLXFENUALF-GFCCVEGCSA-N
【SMILES】
CC(C)(C)OC(=O)N1CC(=O)OC[C@@H]1c2ccccc2
【MOL File】
(5S)-N-(TERT-BUTOXYC….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(5S)-N-(TERT-BUTOXYCARBONYL)-3,4,5,6-TETRAHYDRO-5-PHENYL-4(H)-1,4-OXAZIN-2-ONE.cml