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Home > Bromides > 1241752-33-9
1241752-33-9 | Pyridine, 5-bromo-3-methoxy-2-(1-methylethoxy)-
CAS No: 1241752-33-9 Catalog No: AG000LMQ MDL No:
Product Description
Catalog Number:
AG000LMQ
Chemical Name:
Pyridine, 5-bromo-3-methoxy-2-(1-methylethoxy)-
CAS Number:
1241752-33-9
Molecular Formula:
C9H12BrNO2
Molecular Weight:
246.1011
IUPAC Name:
5-bromo-3-methoxy-2-propan-2-yloxypyridine
InChI:
InChI=1S/C9H12BrNO2/c1-6(2)13-9-8(12-3)4-7(10)5-11-9/h4-6H,1-3H3
InChI Key:
HKGDRUTURBPGEY-UHFFFAOYSA-N
SMILES:
COc1cc(Br)cnc1OC(C)C
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.005g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.104g/mol
Monoisotopic Mass:
245.005g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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