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23489-01-2 | Piperidinium, 1-ethyl-1-octyl-, bromide (1:1)
CAS No: 23489-01-2 Catalog No: AG002NDV MDL No:
Product Description
Catalog Number:
AG002NDV
Chemical Name:
Piperidinium, 1-ethyl-1-octyl-, bromide (1:1)
CAS Number:
23489-01-2
Molecular Formula:
C15H32BrN
Molecular Weight:
306.3253
IUPAC Name:
1-ethyl-1-octylpiperidin-1-ium;bromide
InChI:
InChI=1S/C15H32N.BrH/c1-3-5-6-7-8-10-13-16(4-2)14-11-9-12-15-16;/h3-15H2,1-2H3;1H/q+1;/p-1
InChI Key:
OYVULUZBDZCRFD-UHFFFAOYSA-M
SMILES:
CCCCCCCC[N+]1(CC)CCCCC1.[Br-]
NSC Number:
268366
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.172g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.332g/mol
Monoisotopic Mass:
305.172g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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