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Home > Imidazoles > 887276-30-4
887276-30-4 | 1H-Imidazolium, 1-butyl-3-(2-propenyl)-, chloride
CAS No: 887276-30-4 Catalog No: AG0045MC MDL No:
Product Description
Catalog Number:
AG0045MC
Chemical Name:
1H-Imidazolium, 1-butyl-3-(2-propenyl)-, chloride
CAS Number:
887276-30-4
Molecular Formula:
C10H19ClN2
Molecular Weight:
202.7243
IUPAC Name:
1-butyl-3-prop-2-enyl-1,2-dihydroimidazol-1-ium;chloride
InChI:
InChI=1S/C10H18N2.ClH/c1-3-5-7-12-9-8-11(10-12)6-4-2;/h4,8-9H,2-3,5-7,10H2,1H3;1H
InChI Key:
KNFMDLARWSEOSA-UHFFFAOYSA-N
SMILES:
CCCC[NH+]1C=CN(C1)CC=C.[Cl-]
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.124g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.726g/mol
Monoisotopic Mass:
202.124g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
7.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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