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Home > Pyridines > 100906-88-5
100906-88-5 | Pyridinium, 1-(4-ethylphenyl)-, chloride (1:1)
CAS No: 100906-88-5 Catalog No: AG00035A MDL No:
Product Description
Catalog Number:
AG00035A
Chemical Name:
Pyridinium, 1-(4-ethylphenyl)-, chloride (1:1)
CAS Number:
100906-88-5
Molecular Formula:
C13H14ClN
Molecular Weight:
219.7100
IUPAC Name:
1-(4-ethylphenyl)pyridin-1-ium;chloride
InChI:
InChI=1S/C13H14N.ClH/c1-2-12-6-8-13(9-7-12)14-10-4-3-5-11-14;/h3-11H,2H2,1H3;1H/q+1;/p-1
InChI Key:
ZNPNUEJRZJEPPB-UHFFFAOYSA-M
SMILES:
CCc1ccc(cc1)[n+]1ccccc1.[Cl-]
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.081g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.712g/mol
Monoisotopic Mass:
219.081g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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