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402846-78-0 | 1-Butyl-2,3-dimethylimidazolium Tetrafluoroborate
CAS No: 402846-78-0 Catalog No: AG003EJZ MDL No:MFCD03427618
Product Description
Catalog Number:
AG003EJZ
Chemical Name:
1-Butyl-2,3-dimethylimidazolium Tetrafluoroborate
CAS Number:
402846-78-0
Molecular Formula:
C9H17BF4N2
Molecular Weight:
240.0493
MDL Number:
MFCD03427618
IUPAC Name:
1-butyl-2,3-dimethylimidazol-3-ium;tetrafluoroborate
InChI:
InChI=1S/C9H17N2.BF4/c1-4-5-6-11-8-7-10(3)9(11)2;2-1(3,4)5/h7-8H,4-6H2,1-3H3;/q+1;-1
InChI Key:
VCAIYEJBOWHUGP-UHFFFAOYSA-N
SMILES:
F[B-](F)(F)F.CCCCn1cc[n+](c1C)C
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.142g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.053g/mol
Monoisotopic Mass:
240.142g/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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