503610-08-0
3-PYRIDINEMETHANOL, 5-BUTYL-4-(4-FLUORO-2-HYDROXYPHENYL)-ALPHA-METHYL-2,6-BIS(1-METHYLETHYL)-, (ALPHAR,4S)-
Name3-PYRIDINEMETHANOL, 5-BUTYL-4-(4-FLUORO-2-HYDROXYPHENYL)-ALPHA-METHYL-2,6-BIS(1-METHYLETHYL)-, (ALPHAR,4S)-
1Identification
【Name】
3-PYRIDINEMETHANOL, 5-BUTYL-4-(4-FLUORO-2-HYDROXYPHENYL)-ALPHA-METHYL-2,6-BIS(1-METHYLETHYL)-, (ALPHAR,4S)-
【CAS】
【MDL】
MFCD11616239
【English Synonyms】
【Formula】
C23 H34 F N O2
【MolWeight】
375.525
【Inchi】
InChI=1S/C23H34FNO2/c1-7-8-9-18-21(17-11-10-16(24)12-19(17)27)20(15(6)26)23(14(4)5)25-22(18)13(2)3/h10-15,21,25-27H,7-9H2,1-6H3/t15-,21+/m1/s1
【InChIKey】
InChIKey=QQZZWLWHWXXPBP-VFNWGFHPSA-N
【SMILES】
CCCCC1=C(NC(=C([C@H]1c2ccc(cc2O)F)[C@@H](C)O)C(C)C)C(C)C
【MOL File】
3-PYRIDINEMETHANOL, ….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:3
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-PYRIDINEMETHANOL, 5-BUTYL-4-(4-FLUORO-2-HYDROXYPHENYL)-ALPHA-METHYL-2,6-BIS(1-METHYLETHYL)-, (ALPHAR,4S)-.cml