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192873-50-0 | 1H-Imidazolium, 1-(2-amino-2-oxoethyl)-3-ethenyl-, chloride (1:1)
CAS No: 192873-50-0 Catalog No: AG002GF8 MDL No:
Product Description
Catalog Number:
AG002GF8
Chemical Name:
1H-Imidazolium, 1-(2-amino-2-oxoethyl)-3-ethenyl-, chloride (1:1)
CAS Number:
192873-50-0
Molecular Formula:
C7H12ClN3O
Molecular Weight:
189.6427
IUPAC Name:
2-(3-ethenyl-1,2-dihydroimidazol-1-ium-1-yl)acetamide;chloride
InChI:
InChI=1S/C7H11N3O.ClH/c1-2-9-3-4-10(6-9)5-7(8)11;/h2-4H,1,5-6H2,(H2,8,11);1H
InChI Key:
DWPDCLRZFCUZLY-UHFFFAOYSA-N
SMILES:
NC(=O)C[NH+]1CN(C=C1)C=C.[Cl-]
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.067g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
189.643g/mol
Monoisotopic Mass:
189.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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