503559-82-8
3-PYRIDINECARBOXALDEHYDE, 4-[4-FLUORO-2-(PHENYLMETHOXY)PHENYL]-2,6-BIS(1-METHYLETHYL)-5-(1-PENTEN-1-YL)-
Name
3-PYRIDINECARBOXALDEHYDE, 4-[4-FLUORO-2-(PHENYLMETHOXY)PHENYL]-2,6-BIS(1-METHYLETHYL)-5-(1-PENTEN-1-YL)-
Formula
C30 H34 F N O2
MolWeight
459.602
1Identification
【Name】
3-PYRIDINECARBOXALDEHYDE, 4-[4-FLUORO-2-(PHENYLMETHOXY)PHENYL]-2,6-BIS(1-METHYLETHYL)-5-(1-PENTEN-1-YL)-
【CAS】
【MDL】
MFCD11616223
【English Synonyms】
【Formula】
C30 H34 F N O2
【MolWeight】
459.602
【Inchi】
InChI=1S/C30H34FNO2/c1-6-7-9-14-25-28(26(18-33)30(21(4)5)32-29(25)20(2)3)24-16-15-23(31)17-27(24)34-19-22-12-10-8-11-13-22/h8-18,20-21H,6-7,19H2,1-5H3/b14-9+
【InChIKey】
InChIKey=BYJWMYMACIYVCQ-NTEUORMPSA-N
【SMILES】
CCC/C=C/c1c(c(c(nc1C(C)C)C(C)C)C=O)c2ccc(cc2OCc3ccccc3)F
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:9.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-PYRIDINECARBOXALDEHYDE, 4-[4-FLUORO-2-(PHENYLMETHOXY)PHENYL]-2,6-BIS(1-METHYLETHYL)-5-(1-PENTEN-1-YL)-.cml
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