572923-00-3
(S)-4-(4-ISOPROPYL-2-OXOOXAZOLIDIN-3-YL)BENZALDEHYDE
Name(S)-4-(4-ISOPROPYL-2-OXOOXAZOLIDIN-3-YL)BENZALDEHYDE
1Identification
【Name】
(S)-4-(4-ISOPROPYL-2-OXOOXAZOLIDIN-3-YL)BENZALDEHYDE
【CAS】
【MDL】
MFCD08437342
【English Synonyms】
【Formula】
C13 H15 N O3
【MolWeight】
233.266
【Inchi】
InChI=1S/C13H15NO3/c1-9(2)12-8-17-13(16)14(12)11-5-3-10(7-15)4-6-11/h3-7,9,12H,8H2,1-2H3/t12-/m1/s1
【InChIKey】
InChIKey=MXZVTDFURBBSJT-GFCCVEGCSA-N
【SMILES】
CC(C)[C@H]1COC(=O)N1c2ccc(cc2)C=O
【MOL File】
(S)-4-(4-ISOPROPYL-2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(S)-4-(4-ISOPROPYL-2-OXOOXAZOLIDIN-3-YL)BENZALDEHYDE.cml