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Home > Bromides > 1215838-59-7
1215838-59-7 | 1-[(6-Bromopyridin-2-yl)methyl]piperidine-4-carboxylic acid
CAS No: 1215838-59-7 Catalog No: AG01ER13 MDL No:
Product Description
Catalog Number:
AG01ER13
Chemical Name:
1-[(6-Bromopyridin-2-yl)methyl]piperidine-4-carboxylic acid
CAS Number:
1215838-59-7
Molecular Formula:
C12H15BrN2O2
Molecular Weight:
299.1637
IUPAC Name:
1-[(6-bromopyridin-2-yl)methyl]piperidine-4-carboxylic acid
InChI:
InChI=1S/C12H15BrN2O2/c13-11-3-1-2-10(14-11)8-15-6-4-9(5-7-15)12(16)17/h1-3,9H,4-8H2,(H,16,17)
InChI Key:
WMIWLEMAXKVVRP-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCN(CC1)Cc1cccc(n1)Br
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.032g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
299.168g/mol
Monoisotopic Mass:
298.032g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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