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88836-27-5 | Piperidine, 1-(3-bromo-1-methylpropyl)-2,6-dimethyl-, hydrobromide
CAS No: 88836-27-5 Catalog No: AG004C10 MDL No:
Product Description
Catalog Number:
AG004C10
Chemical Name:
Piperidine, 1-(3-bromo-1-methylpropyl)-2,6-dimethyl-, hydrobromide
CAS Number:
88836-27-5
Molecular Formula:
C11H23Br2N
Molecular Weight:
329.1150
IUPAC Name:
1-(4-bromobutan-2-yl)-2,6-dimethylpiperidine;hydrobromide
InChI:
InChI=1S/C11H22BrN.BrH/c1-9-5-4-6-10(2)13(9)11(3)7-8-12;/h9-11H,4-8H2,1-3H3;1H
InChI Key:
VDAHQUVFGRIFJV-UHFFFAOYSA-N
SMILES:
BrCCC(N1C(C)CCCC1C)C.Br
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.018g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
329.12g/mol
Monoisotopic Mass:
327.02g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
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