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168823-65-2 | Pyridine, 2-(3-bromo-4-methoxyphenyl)-
CAS No: 168823-65-2 Catalog No: AG001YBH MDL No:MFCD05864835
Product Description
Catalog Number:
AG001YBH
Chemical Name:
Pyridine, 2-(3-bromo-4-methoxyphenyl)-
CAS Number:
168823-65-2
Molecular Formula:
C12H10BrNO
Molecular Weight:
264.1179
MDL Number:
MFCD05864835
IUPAC Name:
2-(3-bromo-4-methoxyphenyl)pyridine
InChI:
InChI=1S/C12H10BrNO/c1-15-12-6-5-9(8-10(12)13)11-4-2-3-7-14-11/h2-8H,1H3
InChI Key:
LYSIPJHKCFWZRU-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1Br)c1ccccn1
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.995g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.122g/mol
Monoisotopic Mass:
262.995g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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