2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan

C22H24O — CID 101485529

IUPAC2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan
SMILESCC(C)c1ccccc1-c1cccc(C(C)C)c1-c1ccco1
InChIInChI=1S/C22H24O/c1-15(2)17-9-5-6-10-19(17)20-12-7-11-18(16(3)4)22(20)21-13-8-14-23-21/h5-16H,1-4H3
InChIKeyFLHSZFKZNMSWKW-UHFFFAOYSA-N
MW304.43 g/mol
LogP6.86
Rot. Bonds4

About 2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan

2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan (PubChem CID 101485529) has the molecular formula C22H24O and a molecular weight of 304.43 g/mol. Its IUPAC name is 2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan.

Molecular Properties

Compound Name2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan
PubChem CID101485529
Molecular FormulaC22H24O
Molecular Weight304.43 g/mol
Exact Mass304.18
IUPAC Name2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan
SMILESCC(C)c1ccccc1-c1cccc(C(C)C)c1-c1ccco1
InChIInChI=1S/C22H24O/c1-15(2)17-9-5-6-10-19(17)20-12-7-11-18(16(3)4)22(20)21-13-8-14-23-21/h5-16H,1-4H3
InChIKeyFLHSZFKZNMSWKW-UHFFFAOYSA-N
XLogP6.86
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.43
LogP ≤ 56.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan?
The IUPAC name of 2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan (CID 101485529) is 2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan.
What is the SMILES notation for 2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan?
The canonical SMILES for 2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan is CC(C)c1ccccc1-c1cccc(C(C)C)c1-c1ccco1.
What is the InChIKey of 2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan?
The InChIKey is FLHSZFKZNMSWKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24O/c1-15(2)17-9-5-6-10-19(17)20-12-7-11-18(16(3)4)22(20)21-13-8-14-23-21/h5-16H,1-4H3.
What are the key properties of 2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan?
2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan has a molecular weight of 304.43 g/mol, XLogP of 6.86, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-propan-2-yl-6-(2-propan-2-ylphenyl)phenyl]furan is sourced from PubChem (CID 101485529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).