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10129-51-8 | Pyridinium, 1,3-dimethyl-, iodide (1:1)
CAS No: 10129-51-8 Catalog No: AG00045Y MDL No:
Product Description
Catalog Number:
AG00045Y
Chemical Name:
Pyridinium, 1,3-dimethyl-, iodide (1:1)
CAS Number:
10129-51-8
Molecular Formula:
C7H10IN
Molecular Weight:
235.0655
IUPAC Name:
1,3-dimethylpyridin-1-ium;iodide
InChI:
InChI=1S/C7H10N.HI/c1-7-4-3-5-8(2)6-7;/h3-6H,1-2H3;1H/q+1;/p-1
InChI Key:
BVUPLMFUPRCOEH-UHFFFAOYSA-M
SMILES:
Cc1ccc[n+](c1)C.[I-]
Properties
Complexity:
70.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.986g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.068g/mol
Monoisotopic Mass:
234.986g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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