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Home > Imidazoles > 133070-25-4
133070-25-4 | Cycloheptimidazolium, 1-methyl-, iodide (1:1)
CAS No: 133070-25-4 Catalog No: AG00145S MDL No:
Product Description
Catalog Number:
AG00145S
Chemical Name:
Cycloheptimidazolium, 1-methyl-, iodide (1:1)
CAS Number:
133070-25-4
Molecular Formula:
C9H9IN2
Molecular Weight:
272.0856
IUPAC Name:
3-methylcyclohepta[d]imidazol-3-ium;iodide
InChI:
InChI=1S/C9H9N2.HI/c1-11-7-10-8-5-3-2-4-6-9(8)11;/h2-7H,1H3;1H/q+1;/p-1
InChI Key:
ADJFTFAXTCLTDB-UHFFFAOYSA-M
SMILES:
C[n+]1cnc2c1ccccc2.[I-]
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.981g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.089g/mol
Monoisotopic Mass:
271.981g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
16.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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