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Home > Imidazoles > 516474-01-4
516474-01-4 | 1-ETHYL-3-METHYLIMIDAZOLIUM METHYLSULFATE
CAS No: 516474-01-4 Catalog No: AG00DBZR MDL No:MFCD08457697
Product Description
Catalog Number:
AG00DBZR
Chemical Name:
1-ETHYL-3-METHYLIMIDAZOLIUM METHYLSULFATE
CAS Number:
516474-01-4
Molecular Formula:
C7H14N2O4S
Molecular Weight:
222.2621
MDL Number:
MFCD08457697
IUPAC Name:
1-ethyl-3-methylimidazol-3-ium;methyl sulfate
InChI:
InChI=1S/C6H11N2.CH4O4S/c1-3-8-5-4-7(2)6-8;1-5-6(2,3)4/h4-6H,3H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1
InChI Key:
BXSDLSWVIAITRQ-UHFFFAOYSA-M
SMILES:
COS(=O)(=O)[O-].CCn1cc[n+](c1)C
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.067g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.259g/mol
Monoisotopic Mass:
222.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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