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433302-49-9

433302-49-9 | 3-methyl-1-(pyrrolidine-1-carbonyl)-1H-imidazol-3-ium iodide

CAS No: 433302-49-9 Catalog No: AG019MIG MDL No:MFCD10686885

Product Description

Catalog Number:
AG019MIG
Chemical Name:
3-methyl-1-(pyrrolidine-1-carbonyl)-1H-imidazol-3-ium iodide
CAS Number:
433302-49-9
Molecular Formula:
C9H14IN3O
Molecular Weight:
307.1314
MDL Number:
MFCD10686885
IUPAC Name:
(3-methylimidazol-3-ium-1-yl)-pyrrolidin-1-ylmethanone;iodide
InChI:
InChI=1S/C9H14N3O.HI/c1-10-6-7-12(8-10)9(13)11-4-2-3-5-11;/h6-8H,2-5H2,1H3;1H/q+1;/p-1
InChI Key:
FNYAIQDLIIMWCJ-UHFFFAOYSA-M
SMILES:
C[n+]1ccn(c1)C(=O)N1CCCC1.[I-]

Properties

Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.018g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.135g/mol
Monoisotopic Mass:
307.018g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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