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1251279-15-8 | 1-(2-Bromobenzyl)-2-methylpiperidine
CAS No: 1251279-15-8 Catalog No: AG01ERA3 MDL No:
Product Description
Catalog Number:
AG01ERA3
Chemical Name:
1-(2-Bromobenzyl)-2-methylpiperidine
CAS Number:
1251279-15-8
Molecular Formula:
C13H18BrN
Molecular Weight:
268.1927
IUPAC Name:
1-[(2-bromophenyl)methyl]-2-methylpiperidine
InChI:
InChI=1S/C13H18BrN/c1-11-6-4-5-9-15(11)10-12-7-2-3-8-13(12)14/h2-3,7-8,11H,4-6,9-10H2,1H3
InChI Key:
BOXLAPJBPBVZFU-UHFFFAOYSA-N
SMILES:
CC1CCCCN1Cc1ccccc1Br
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.062g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.198g/mol
Monoisotopic Mass:
267.062g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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