1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid)

C12H20F4N2O8 — CID 175410531

IUPAC1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid)
SMILESCCCCN1C=CN(C)C1.O=C(O)F.O=C(O)F.O=C(O)F.O=C(O)F
InChIInChI=1S/C8H16N2.4CHFO2/c1-3-4-5-10-7-6-9(2)8-10;4*2-1(3)4/h6-7H,3-5,8H2,1-2H3;4*(H,3,4)
InChIKeyGSWWDMSHOHVLIY-UHFFFAOYSA-N
MW396.29 g/mol
LogP4.00
Rot. Bonds3

About 1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid)

1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid) (PubChem CID 175410531) has the molecular formula C12H20F4N2O8 and a molecular weight of 396.29 g/mol. Its IUPAC name is 1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid).

Molecular Properties

Compound Name1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid)
PubChem CID175410531
Molecular FormulaC12H20F4N2O8
Molecular Weight396.29 g/mol
Exact Mass396.12
IUPAC Name1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid)
SMILESCCCCN1C=CN(C)C1.O=C(O)F.O=C(O)F.O=C(O)F.O=C(O)F
InChIInChI=1S/C8H16N2.4CHFO2/c1-3-4-5-10-7-6-9(2)8-10;4*2-1(3)4/h6-7H,3-5,8H2,1-2H3;4*(H,3,4)
InChIKeyGSWWDMSHOHVLIY-UHFFFAOYSA-N
XLogP4.00
TPSA155.68 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.29
LogP ≤ 54.00
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acid_halide', 'substructure': 'N/A'}

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Related Compounds

1-butyl-3-methyl-2H-imidazole
CID 10265934
1-butyl-3-methyl-2H-imidazole;phosphorous acid
CID 174659773
1-butyl-3-methyl-2H-imidazole;molybdenum
CID 174105929
CID 175550645
CID 175550645
fluoromethane;1-hexyl-3-methyl-2H-imidazole
CID 174715359
zinc;1-butyl-3-methyl-2H-imidazole;ditetrafluoroborate
CID 175542670
1-methyl-3-nonadecyl-2H-imidazole
CID 69396698
1-hexyl-3-methyl-2H-imidazole
CID 18513318
tripotassium;1-butyl-3-methyl-2H-imidazole;hydride
CID 174886963
1-butyl-3-methyl-2H-imidazole;phosphane;hexahydrofluoride
CID 173166047
1-butyl-3-methyl-2H-imidazole;hydron;hexafluorophosphate
CID 174451662
1-butyl-3-methyl-2H-imidazole;phosphoric acid;tetrafluoroborate
CID 175710160

Frequently Asked Questions

What is the IUPAC name of 1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid)?
The IUPAC name of 1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid) (CID 175410531) is 1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid).
What is the SMILES notation for 1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid)?
The canonical SMILES for 1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid) is CCCCN1C=CN(C)C1.O=C(O)F.O=C(O)F.O=C(O)F.O=C(O)F.
What is the InChIKey of 1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid)?
The InChIKey is GSWWDMSHOHVLIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2.4CHFO2/c1-3-4-5-10-7-6-9(2)8-10;4*2-1(3)4/h6-7H,3-5,8H2,1-2H3;4*(H,3,4).
What are the key properties of 1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid)?
1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid) has a molecular weight of 396.29 g/mol, XLogP of 4.00, 3 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-3-methyl-2H-imidazole;tetrakis(carbonofluoridic acid) is sourced from PubChem (CID 175410531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).