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Home > Fluorides > 124864-27-3
124864-27-3 | 3-Pyridinemethanol, 4-(4-fluorophenyl)-5-(methoxymethyl)-2,6-bis(1-methylethyl)-
CAS No: 124864-27-3 Catalog No: AG000MTQ MDL No:
Product Description
Catalog Number:
AG000MTQ
Chemical Name:
3-Pyridinemethanol, 4-(4-fluorophenyl)-5-(methoxymethyl)-2,6-bis(1-methylethyl)-
CAS Number:
124864-27-3
Molecular Formula:
C20H26FNO2
Molecular Weight:
331.4243
IUPAC Name:
[4-(4-fluorophenyl)-5-(methoxymethyl)-2,6-di(propan-2-yl)pyridin-3-yl]methanol
InChI:
InChI=1S/C20H26FNO2/c1-12(2)19-16(10-23)18(14-6-8-15(21)9-7-14)17(11-24-5)20(22-19)13(3)4/h6-9,12-13,23H,10-11H2,1-5H3
InChI Key:
AIDFFEQVXJRKCP-UHFFFAOYSA-N
SMILES:
COCc1c(nc(c(c1c1ccc(cc1)F)CO)C(C)C)C(C)C
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.195g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
331.431g/mol
Monoisotopic Mass:
331.195g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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