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65039-05-6 | 1-Butyl-3-methylimidazolium Iodide
CAS No: 65039-05-6 Catalog No: AG003B1E MDL No:MFCD08276307
Product Description
Catalog Number:
AG003B1E
Chemical Name:
1-Butyl-3-methylimidazolium Iodide
CAS Number:
65039-05-6
Molecular Formula:
C8H15IN2
Molecular Weight:
266.1226
MDL Number:
MFCD08276307
IUPAC Name:
1-butyl-3-methylimidazol-3-ium;iodide
InChI:
InChI=1S/C8H15N2.HI/c1-3-4-5-10-7-6-9(2)8-10;/h6-8H,3-5H2,1-2H3;1H/q+1;/p-1
InChI Key:
XREPTGNZZKNFQZ-UHFFFAOYSA-M
SMILES:
CCCCn1cc[n+](c1)C.[I-]
Properties
Complexity:
93.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.028g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.126g/mol
Monoisotopic Mass:
266.028g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
8.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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