2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran

C30H30O2 — CID 102326421

IUPAC2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran
SMILESCC(C)(C)c1ccc(-c2cc3cc4oc(-c5ccc(C(C)(C)C)cc5)cc4cc3o2)cc1
InChIInChI=1S/C30H30O2/c1-29(2,3)23-11-7-19(8-12-23)25-15-21-17-28-22(18-27(21)31-25)16-26(32-28)20-9-13-24(14-10-20)30(4,5)6/h7-18H,1-6H3
InChIKeyPLRIFJXMAKSHKJ-UHFFFAOYSA-N
MW422.57 g/mol
LogP9.11
Rot. Bonds2

About 2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran

2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran (PubChem CID 102326421) has the molecular formula C30H30O2 and a molecular weight of 422.57 g/mol. Its IUPAC name is 2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran.

Molecular Properties

Compound Name2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran
PubChem CID102326421
Molecular FormulaC30H30O2
Molecular Weight422.57 g/mol
Exact Mass422.22
IUPAC Name2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran
SMILESCC(C)(C)c1ccc(-c2cc3cc4oc(-c5ccc(C(C)(C)C)cc5)cc4cc3o2)cc1
InChIInChI=1S/C30H30O2/c1-29(2,3)23-11-7-19(8-12-23)25-15-21-17-28-22(18-27(21)31-25)16-26(32-28)20-9-13-24(14-10-20)30(4,5)6/h7-18H,1-6H3
InChIKeyPLRIFJXMAKSHKJ-UHFFFAOYSA-N
XLogP9.11
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.57
LogP ≤ 59.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-tert-butylphenyl)-1-benzofuran-6-carbaldehyde
CID 129115921
5-tert-butyl-2-(5-tert-butyl-1-benzofuran-2-yl)-1-benzofuran
CID 102492573
7-bromo-2-(4-tert-butylphenyl)benzo[e][1]benzofuran
CID 132507585
2-(4-tert-butylphenyl)-5-(3,5-dimethylphenyl)furo[3,2-b]pyridine
CID 155628492
2-(4-tert-butylphenyl)-6-methoxychromen-4-one
CID 776400
2-[22-(4-tert-butylphenyl)-5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19(24),20,22,26-dodecaenyl]-1-benzofuran
CID 59413412
3-(4-tert-butylphenyl)azuleno[1,2-c]pyran-1-one
CID 165369400
2-[3,6,8-tris(4-tert-butylphenyl)pyren-1-yl]-1-benzofuran
CID 59390421
2-(4-tert-butylphenyl)-6,7-dihydro-5H-1-benzofuran-4-one
CID 71770486
6-(3-tert-butyl-5-methylphenyl)-2-(4-tert-butylphenyl)furo[2,3-b]pyridine
CID 155629218
6-(1-benzofuran-2-yl)-N-(4-tert-butylphenyl)-N-(4-methylphenyl)naphthalen-2-amine
CID 171422549
7-amino-3-(4-tert-butylphenyl)chromen-2-one
CID 172825366

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran?
The IUPAC name of 2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran (CID 102326421) is 2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran.
What is the SMILES notation for 2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran?
The canonical SMILES for 2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran is CC(C)(C)c1ccc(-c2cc3cc4oc(-c5ccc(C(C)(C)C)cc5)cc4cc3o2)cc1.
What is the InChIKey of 2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran?
The InChIKey is PLRIFJXMAKSHKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H30O2/c1-29(2,3)23-11-7-19(8-12-23)25-15-21-17-28-22(18-27(21)31-25)16-26(32-28)20-9-13-24(14-10-20)30(4,5)6/h7-18H,1-6H3.
What are the key properties of 2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran?
2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran has a molecular weight of 422.57 g/mol, XLogP of 9.11, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(4-tert-butylphenyl)furo[2,3-f][1]benzofuran is sourced from PubChem (CID 102326421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).