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1233952-50-5 | 4-Bromo-N-(piperidin-4-yl)benzamide hydrochloride
CAS No: 1233952-50-5 Catalog No: AG01F97G MDL No:
Product Description
Catalog Number:
AG01F97G
Chemical Name:
4-Bromo-N-(piperidin-4-yl)benzamide hydrochloride
CAS Number:
1233952-50-5
Molecular Formula:
C12H16BrClN2O
Molecular Weight:
319.6252
IUPAC Name:
4-bromo-N-piperidin-4-ylbenzamide;hydrochloride
InChI:
InChI=1S/C12H15BrN2O.ClH/c13-10-3-1-9(2-4-10)12(16)15-11-5-7-14-8-6-11;/h1-4,11,14H,5-8H2,(H,15,16);1H
InChI Key:
QLNDQHUDWGOXFM-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)Br)NC1CCNCC1.Cl
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.013g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
319.627g/mol
Monoisotopic Mass:
318.013g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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