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Home > Bromides > 1227576-08-0
1227576-08-0 | Pyridine, 3-(bromomethyl)-2-methoxy-5-(trifluoromethyl)-
CAS No: 1227576-08-0 Catalog No: AG000JC8 MDL No:MFCD16610204
Product Description
Catalog Number:
AG000JC8
Chemical Name:
Pyridine, 3-(bromomethyl)-2-methoxy-5-(trifluoromethyl)-
CAS Number:
1227576-08-0
Molecular Formula:
C8H7BrF3NO
Molecular Weight:
270.0465
MDL Number:
MFCD16610204
IUPAC Name:
3-(bromomethyl)-2-methoxy-5-(trifluoromethyl)pyridine
InChI:
InChI=1S/C8H7BrF3NO/c1-14-7-5(3-9)2-6(4-13-7)8(10,11)12/h2,4H,3H2,1H3
InChI Key:
JQRHSRBXDHBCPM-UHFFFAOYSA-N
SMILES:
BrCc1cc(cnc1OC)C(F)(F)F
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.966g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.049g/mol
Monoisotopic Mass:
268.966g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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