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Home > Bromides > 1289131-50-5
1289131-50-5 | Pyridine, 4-bromo-2-(1-methylpropoxy)-
CAS No: 1289131-50-5 Catalog No: AG000YIH MDL No:
Product Description
Catalog Number:
AG000YIH
Chemical Name:
Pyridine, 4-bromo-2-(1-methylpropoxy)-
CAS Number:
1289131-50-5
Molecular Formula:
C9H12BrNO
Molecular Weight:
230.1017
IUPAC Name:
4-bromo-2-butan-2-yloxypyridine
InChI:
InChI=1S/C9H12BrNO/c1-3-7(2)12-9-6-8(10)4-5-11-9/h4-7H,3H2,1-2H3
InChI Key:
BJNQUGKLWDRTLP-UHFFFAOYSA-N
SMILES:
CC(Oc1cc(Br)ccn1)CC
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.01g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.105g/mol
Monoisotopic Mass:
229.01g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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