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Home > Bromides > 1214377-42-0
1214377-42-0 | Pyridine, 5-bromo-2-methoxy-3-(trifluoromethyl)-
CAS No: 1214377-42-0 Catalog No: AG0014Y2 MDL No:MFCD13185815
Product Description
Catalog Number:
AG0014Y2
Chemical Name:
Pyridine, 5-bromo-2-methoxy-3-(trifluoromethyl)-
CAS Number:
1214377-42-0
Molecular Formula:
C7H5BrF3NO
Molecular Weight:
256.0199
MDL Number:
MFCD13185815
IUPAC Name:
5-bromo-2-methoxy-3-(trifluoromethyl)pyridine
InChI:
InChI=1S/C7H5BrF3NO/c1-13-6-5(7(9,10)11)2-4(8)3-12-6/h2-3H,1H3
InChI Key:
ZIOFHXRZJCIBCO-UHFFFAOYSA-N
SMILES:
COc1ncc(cc1C(F)(F)F)Br
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.951g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.022g/mol
Monoisotopic Mass:
254.951g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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