2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-)

C7H10F6N2O2Sb- — CID 175560038

IUPAC2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-)
SMILESC=CN1C=CN(CC(=O)O)C1.F[Sb-](F)(F)(F)(F)F
InChIInChI=1S/C7H10N2O2.6FH.Sb/c1-2-8-3-4-9(6-8)5-7(10)11;;;;;;;/h2-4H,1,5-6H2,(H,10,11);6*1H;/q;;;;;;;+5/p-6
InChIKeyRCSBDSRGKHNYNY-UHFFFAOYSA-H
MW389.92 g/mol
LogP2.40
Rot. Bonds3

About 2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-)

2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-) (PubChem CID 175560038) has the molecular formula C7H10F6N2O2Sb- and a molecular weight of 389.92 g/mol. Its IUPAC name is 2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-).

Molecular Properties

Compound Name2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-)
PubChem CID175560038
Molecular FormulaC7H10F6N2O2Sb-
Molecular Weight389.92 g/mol
Exact Mass388.97
IUPAC Name2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-)
SMILESC=CN1C=CN(CC(=O)O)C1.F[Sb-](F)(F)(F)(F)F
InChIInChI=1S/C7H10N2O2.6FH.Sb/c1-2-8-3-4-9(6-8)5-7(10)11;;;;;;;/h2-4H,1,5-6H2,(H,10,11);6*1H;/q;;;;;;;+5/p-6
InChIKeyRCSBDSRGKHNYNY-UHFFFAOYSA-H
XLogP2.40
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.92
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-ethenyl-3-prop-2-enyl-2H-imidazole;2,2,2-trifluoroacetic acid
CID 174748376
5-(3-ethenyl-2H-imidazol-1-yl)-2-methylpent-2-enoic acid
CID 174665724
1-ethenyl-3-ethyl-2H-imidazole;2-methylprop-2-enoic acid;tetrafluoroborate
CID 174865010
5-(3-ethenyl-2H-imidazol-1-yl)pentanamide
CID 174918742
2-(3-ethenyl-2H-imidazol-1-yl)ethanol tetrafluoroborate
CID 159541886
1-decyl-3-ethenyl-2H-imidazole;prop-2-enoic acid;hydrobromide
CID 175052158
2-(3-ethyl-2H-imidazol-1-yl)acetic acid
CID 89172390
1-ethenyl-3-ethyl-2H-imidazole;hydrobromide
CID 172862570
2-(3-ethenyl-2,3-dihydropyrrol-1-yl)acetic acid;hydrochloride
CID 70019852
1-ethenyl-3-pentyl-2H-imidazole
CID 69347119
acetic acid;1-ethenyl-3-methyl-2H-imidazole
CID 174673019
1-butyl-3-ethenyl-2H-imidazole;prop-2-enamide;hydrobromide
CID 175485148

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-)?
The IUPAC name of 2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-) (CID 175560038) is 2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-).
What is the SMILES notation for 2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-)?
The canonical SMILES for 2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-) is C=CN1C=CN(CC(=O)O)C1.F[Sb-](F)(F)(F)(F)F.
What is the InChIKey of 2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-)?
The InChIKey is RCSBDSRGKHNYNY-UHFFFAOYSA-H. The full InChI is InChI=1S/C7H10N2O2.6FH.Sb/c1-2-8-3-4-9(6-8)5-7(10)11;;;;;;;/h2-4H,1,5-6H2,(H,10,11);6*1H;/q;;;;;;;+5/p-6.
What are the key properties of 2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-)?
2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-) has a molecular weight of 389.92 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethenyl-2H-imidazol-1-yl)acetic acid;hexafluoroantimony(1-) is sourced from PubChem (CID 175560038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).