1-benzylfuro[2,3-b][1]benzofuran

C17H12O2 — CID 91574710

IUPAC1-benzylfuro[2,3-b][1]benzofuran
SMILESc1ccc(Cc2coc3oc4ccccc4c23)cc1
InChIInChI=1S/C17H12O2/c1-2-6-12(7-3-1)10-13-11-18-17-16(13)14-8-4-5-9-15(14)19-17/h1-9,11H,10H2
InChIKeySTMLKDVKUOJHFQ-UHFFFAOYSA-N
MW248.28 g/mol
LogP4.77
Rot. Bonds2

About 1-benzylfuro[2,3-b][1]benzofuran

1-benzylfuro[2,3-b][1]benzofuran (PubChem CID 91574710) has the molecular formula C17H12O2 and a molecular weight of 248.28 g/mol. Its IUPAC name is 1-benzylfuro[2,3-b][1]benzofuran.

Molecular Properties

Compound Name1-benzylfuro[2,3-b][1]benzofuran
PubChem CID91574710
Molecular FormulaC17H12O2
Molecular Weight248.28 g/mol
Exact Mass248.08
IUPAC Name1-benzylfuro[2,3-b][1]benzofuran
SMILESc1ccc(Cc2coc3oc4ccccc4c23)cc1
InChIInChI=1S/C17H12O2/c1-2-6-12(7-3-1)10-13-11-18-17-16(13)14-8-4-5-9-15(14)19-17/h1-9,11H,10H2
InChIKeySTMLKDVKUOJHFQ-UHFFFAOYSA-N
XLogP4.77
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(6-Methyl-1-benzofuran-3-yl)acetic acid
CID 877801
2-(1-Benzofuran-3-yl)acetic acid
CID 2762940
3-(4-Methoxybenzoyl)-1-benzofuran-5-yl acetate
CID 868434
2-(6-Ethyl-1-benzofuran-3-yl)acetic acid
CID 2393677
(6-Phenyl-1-benzofuran-3-yl)acetic acid
CID 156026021
[6-(3-Methoxyphenyl)-1-benzofuran-3-yl]acetic acid
CID 156026022
3-(2,5-Dimethoxybenzoyl)-1-benzofuran-5-yl acetate
CID 867287
3-(4-Methoxyphenyl)-5-(5-methylfuran-2-yl)-1-benzofuran
CID 45482677
4-[5-(5-Methylfuran-2-yl)-1-benzofuran-3-yl]benzoic acid
CID 45482681
4-[5-(5-Methylfuran-2-yl)-1-benzofuran-3-yl]phenol
CID 45482690
1-{4-[5-(5-Methyl-1,3,4-oxadiazol-2-yl)-1-benzofuran-3-yl]-phenyl}ethanone
CID 45482695
Methyl 4-[5-(5-methylfuran-2-yl)-1-benzofuran-3-yl]benzoate
CID 45482715

Frequently Asked Questions

What is the IUPAC name of 1-benzylfuro[2,3-b][1]benzofuran?
The IUPAC name of 1-benzylfuro[2,3-b][1]benzofuran (CID 91574710) is 1-benzylfuro[2,3-b][1]benzofuran.
What is the SMILES notation for 1-benzylfuro[2,3-b][1]benzofuran?
The canonical SMILES for 1-benzylfuro[2,3-b][1]benzofuran is c1ccc(Cc2coc3oc4ccccc4c23)cc1.
What is the InChIKey of 1-benzylfuro[2,3-b][1]benzofuran?
The InChIKey is STMLKDVKUOJHFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12O2/c1-2-6-12(7-3-1)10-13-11-18-17-16(13)14-8-4-5-9-15(14)19-17/h1-9,11H,10H2.
What are the key properties of 1-benzylfuro[2,3-b][1]benzofuran?
1-benzylfuro[2,3-b][1]benzofuran has a molecular weight of 248.28 g/mol, XLogP of 4.77, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzylfuro[2,3-b][1]benzofuran is sourced from PubChem (CID 91574710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).