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934000-33-6 | (5-Bromopyridin-2-yl);(piperidin-1-yl);methanone
CAS No: 934000-33-6 Catalog No: AG003BXT MDL No:MFCD08458472
Product Description
Catalog Number:
AG003BXT
Chemical Name:
(5-Bromopyridin-2-yl);(piperidin-1-yl);methanone
CAS Number:
934000-33-6
Molecular Formula:
C11H13BrN2O
Molecular Weight:
269.1377
MDL Number:
MFCD08458472
IUPAC Name:
(5-bromopyridin-2-yl)-piperidin-1-ylmethanone
InChI:
InChI=1S/C11H13BrN2O/c12-9-4-5-10(13-8-9)11(15)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7H2
InChI Key:
LXRFKLKDVHGHIC-UHFFFAOYSA-N
SMILES:
Brc1ccc(nc1)C(=O)N1CCCCC1
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.021g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.142g/mol
Monoisotopic Mass:
268.021g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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