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17810-46-7 | Pyridinium, 5-ethenyl-1,2-dimethyl-, iodide (1:1)
CAS No: 17810-46-7 Catalog No: AG0025RX MDL No:
Product Description
Catalog Number:
AG0025RX
Chemical Name:
Pyridinium, 5-ethenyl-1,2-dimethyl-, iodide (1:1)
CAS Number:
17810-46-7
Molecular Formula:
C9H12IN
Molecular Weight:
261.1028
IUPAC Name:
5-ethenyl-1,2-dimethylpyridin-1-ium;iodide
InChI:
InChI=1S/C9H12N.HI/c1-4-9-6-5-8(2)10(3)7-9;/h4-7H,1H2,2-3H3;1H/q+1;/p-1
InChI Key:
KIDAZMZPXHMJNP-UHFFFAOYSA-M
SMILES:
C=Cc1ccc([n+](c1)C)C.[I-]
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.001g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.106g/mol
Monoisotopic Mass:
261.001g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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