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Home > Bromides > 1256811-02-5
1256811-02-5 | Ethanone, 1-(5-bromo-2-methoxy-3-pyridinyl)-
CAS No: 1256811-02-5 Catalog No: AG000OEL MDL No:MFCD18256150
Product Description
Catalog Number:
AG000OEL
Chemical Name:
Ethanone, 1-(5-bromo-2-methoxy-3-pyridinyl)-
CAS Number:
1256811-02-5
Molecular Formula:
C8H8BrNO2
Molecular Weight:
230.0586
MDL Number:
MFCD18256150
IUPAC Name:
1-(5-bromo-2-methoxypyridin-3-yl)ethanone
InChI:
InChI=1S/C8H8BrNO2/c1-5(11)7-3-6(9)4-10-8(7)12-2/h3-4H,1-2H3
InChI Key:
LXKMRWKPTVIQLG-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc(Br)cnc1OC
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.974g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.061g/mol
Monoisotopic Mass:
228.974g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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