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2517-87-5 | Pyridinium, 1-decyl-3-hydroxy-, chloride (1:1)
CAS No: 2517-87-5 Catalog No: AG002QR7 MDL No:
Product Description
Catalog Number:
AG002QR7
Chemical Name:
Pyridinium, 1-decyl-3-hydroxy-, chloride (1:1)
CAS Number:
2517-87-5
Molecular Formula:
C15H26ClNO
Molecular Weight:
271.8260
IUPAC Name:
1-decylpyridin-1-ium-3-ol;chloride
InChI:
InChI=1S/C15H25NO.ClH/c1-2-3-4-5-6-7-8-9-12-16-13-10-11-15(17)14-16;/h10-11,13-14H,2-9,12H2,1H3;1H
InChI Key:
XIDHOYDJHXGRMK-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC[n+]1cccc(c1)O.[Cl-]
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.17g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
271.829g/mol
Monoisotopic Mass:
271.17g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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