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Home > Bromides > 1260766-34-4
1260766-34-4 | 2-Piperidinone, 3-[(3-bromophenyl)methyl]-
CAS No: 1260766-34-4 Catalog No: AG000R6O MDL No:
Product Description
Catalog Number:
AG000R6O
Chemical Name:
2-Piperidinone, 3-[(3-bromophenyl)methyl]-
CAS Number:
1260766-34-4
Molecular Formula:
C12H14BrNO
Molecular Weight:
268.1497
IUPAC Name:
3-[(3-bromophenyl)methyl]piperidin-2-one
InChI:
InChI=1S/C12H14BrNO/c13-11-5-1-3-9(8-11)7-10-4-2-6-14-12(10)15/h1,3,5,8,10H,2,4,6-7H2,(H,14,15)
InChI Key:
PQAUAGLYDAYTJG-UHFFFAOYSA-N
SMILES:
O=C1NCCCC1Cc1cccc(c1)Br
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.026g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
268.154g/mol
Monoisotopic Mass:
267.026g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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