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Home > Fluorides > 1227598-92-6
1227598-92-6 | 3-Pyridinemethanol, 2,4-difluoro-
CAS No: 1227598-92-6 Catalog No: AG000JE3 MDL No:
Product Description
Catalog Number:
AG000JE3
Chemical Name:
3-Pyridinemethanol, 2,4-difluoro-
CAS Number:
1227598-92-6
Molecular Formula:
C6H5F2NO
Molecular Weight:
145.1068
IUPAC Name:
(2,4-difluoropyridin-3-yl)methanol
InChI:
InChI=1S/C6H5F2NO/c7-5-1-2-9-6(8)4(5)3-10/h1-2,10H,3H2
InChI Key:
BDGKPGWHROUPGL-UHFFFAOYSA-N
SMILES:
OCc1c(F)ccnc1F
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.034g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
145.109g/mol
Monoisotopic Mass:
145.034g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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