Home Carbonyls 1-(2,6-dimethylmorpholine-4-carbonyl)-3-methyl-1H-imidazol-3-ium iodide

1-(2,6-dimethylmorpholine-4-carbonyl)-3-methyl-1H-imidazol-3-ium iodide

CAS No.:
548763-25-3
Catalog Number:
AG019QR9
Molecular Formula:
C11H18IN3O2
Molecular Weight:
351.1840
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Product Description
Catalog Number:
AG019QR9
Chemical Name:
1-(2,6-dimethylmorpholine-4-carbonyl)-3-methyl-1H-imidazol-3-ium iodide
CAS Number:
548763-25-3
Molecular Formula:
C11H18IN3O2
Molecular Weight:
351.1840
MDL Number:
MFCD11099744
IUPAC Name:
(2,6-dimethylmorpholin-4-yl)-(3-methylimidazol-3-ium-1-yl)methanone;iodide
InChI:
InChI=1S/C11H18N3O2.HI/c1-9-6-14(7-10(2)16-9)11(15)13-5-4-12(3)8-13;/h4-5,8-10H,6-7H2,1-3H3;1H/q+1;/p-1
InChI Key:
LRUDQLKDUVNBCQ-UHFFFAOYSA-M
SMILES:
CC1OC(C)CN(C1)C(=O)n1cc[n+](c1)C.[I-]
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.044g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
351.188g/mol
Monoisotopic Mass:
351.044g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.4A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties