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Home > Bromides > 1227502-29-5
1227502-29-5 | 4-Pyridinemethanol, 2-bromo-5-fluoro-
CAS No: 1227502-29-5 Catalog No: AG000J9Z MDL No:MFCD15526921
Product Description
Catalog Number:
AG000J9Z
Chemical Name:
4-Pyridinemethanol, 2-bromo-5-fluoro-
CAS Number:
1227502-29-5
Molecular Formula:
C6H5BrFNO
Molecular Weight:
206.0124
MDL Number:
MFCD15526921
IUPAC Name:
(2-bromo-5-fluoropyridin-4-yl)methanol
InChI:
InChI=1S/C6H5BrFNO/c7-6-1-4(3-10)5(8)2-9-6/h1-2,10H,3H2
InChI Key:
KQMVUTPTMBNBQL-UHFFFAOYSA-N
SMILES:
OCc1cc(Br)ncc1F
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.954g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.014g/mol
Monoisotopic Mass:
204.954g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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