2-Furan-2-yl-1-furan-2-ylmethyl-1H-benzoimidazole
Basic information
- CAS
79324-83-7- Standard SMILES
c1coc(Cn2c(-c3ccco3)nc3ccccc32)c1- InChIKey
BBKODUSYDNJJKK-UHFFFAOYSA-N- Molecular formula
- C16H12N2O2
- Average molar mass
- 264.28 g/mol
- Monoisotopic mass
- 264.08987763
Names & identifiers
- Preferred name
- 2-Furan-2-yl-1-furan-2-ylmethyl-1H-benzoimidazole
- IUPAC
- 2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazole
- English name
- 1H-Benzimidazole, 2-(2-furanyl)-1-(2-furanylmethyl)-
- Molecular formula
- C16H12N2O2
- Molecular weight
- 264.28
Names & synonyms
79324-83-72-Furan-2-yl-1-furan-2-ylmethyl-1H-benzoimidazoleDTXSID10349513RefChem:1063174DTXCID103005831H-Benzimidazole, 2-(2-furanyl)-1-(2-furanylmethyl)-2-(furan-2-yl)-1-(furan-2-ylmethyl)-1H-benzo[d]imidazole2-(Furan-2-yl)-1-[(furan-2-yl)methyl]-1H-benzimidazole2-(furan-2-yl)-1-(furan-2-ylmethyl)benzimidazoleCBMicro_032634ChemDiv2_003153Cambridge id 5973647
Show more names
2-(2-furyl)-1-(2-furylmethyl)benzimidazole
Oprea1_066977Oprea1_766087MLS000072553CHEMBL1417665REGID_for_CID_650866SCHEMBL28378126BBKODUSYDNJJKK-UHFFFAOYSA-NHMS1377P07
Database identifiers
- CAS
79324-83-7- PubChem CID
- 650866
- DTXSID
DTXSID10349513- ChEMBL
CHEMBL1417665- Nikkaji
- J1.984.133B
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 338
Physicochemical properties
- Melting point
- 96 °C · 96 °C
- Boiling point
- 457.8 · 457.8±55.0 °C(Predicted)
- Density
- 1.29 · 1.29±0.1 g/cm3(Predicted)
- pka
- 4.61 · 4.61±0.10(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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