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1228897-82-2 | 2-Pyridinemethanol, 5-chloro-3-(trifluoromethyl)-
CAS No: 1228897-82-2 Catalog No: AG000JOW MDL No:
Product Description
Catalog Number:
AG000JOW
Chemical Name:
2-Pyridinemethanol, 5-chloro-3-(trifluoromethyl)-
CAS Number:
1228897-82-2
Molecular Formula:
C7H5ClF3NO
Molecular Weight:
211.5689
IUPAC Name:
[5-chloro-3-(trifluoromethyl)pyridin-2-yl]methanol
InChI:
InChI=1S/C7H5ClF3NO/c8-4-1-5(7(9,10)11)6(3-13)12-2-4/h1-2,13H,3H2
InChI Key:
UYKBDYAIPBFIRV-UHFFFAOYSA-N
SMILES:
OCc1ncc(cc1C(F)(F)F)Cl
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.001g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.568g/mol
Monoisotopic Mass:
211.001g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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