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Home > Imidazoles > 879395-34-3
879395-34-3 | Pyrrolo[1,2-a]imidazol-4-ium, 1-butyl-1,5,6,7-tetrahydro-, chloride
CAS No: 879395-34-3 Catalog No: AG004GS4 MDL No:
Product Description
Catalog Number:
AG004GS4
Chemical Name:
Pyrrolo[1,2-a]imidazol-4-ium, 1-butyl-1,5,6,7-tetrahydro-, chloride
CAS Number:
879395-34-3
Molecular Formula:
C10H17ClN2
Molecular Weight:
200.7084
IUPAC Name:
1-butyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-4-ium;chloride
InChI:
InChI=1S/C10H17N2.ClH/c1-2-3-6-11-8-9-12-7-4-5-10(11)12;/h8-9H,2-7H2,1H3;1H/q+1;/p-1
InChI Key:
OHYULTMKXFWJTC-UHFFFAOYSA-M
SMILES:
CCCCn1cc[n+]2c1CCC2.[Cl-]
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.108g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.71g/mol
Monoisotopic Mass:
200.108g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
8.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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