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1308669-75-1 | 4-Pyridinemethanol, 3-bromo-5-fluoro-α,α-dimethyl-
CAS No: 1308669-75-1 Catalog No: AG000V1G MDL No:
Product Description
Catalog Number:
AG000V1G
Chemical Name:
4-Pyridinemethanol, 3-bromo-5-fluoro-α,α-dimethyl-
CAS Number:
1308669-75-1
Molecular Formula:
C8H9BrFNO
Molecular Weight:
234.0656
IUPAC Name:
2-(3-bromo-5-fluoropyridin-4-yl)propan-2-ol
InChI:
InChI=1S/C8H9BrFNO/c1-8(2,12)7-5(9)3-11-4-6(7)10/h3-4,12H,1-2H3
InChI Key:
TZQQJKRAHYRQHO-UHFFFAOYSA-N
SMILES:
Fc1cncc(c1C(O)(C)C)Br
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.985g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.068g/mol
Monoisotopic Mass:
232.985g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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