7-methoxy-3,3-diphenylbenzo[f]chromene

C26H20O2 — CID 18954870

IUPAC7-methoxy-3,3-diphenylbenzo[f]chromene
SMILESCOc1cccc2c3c(ccc12)OC(c1ccccc1)(c1ccccc1)C=C3
InChIInChI=1S/C26H20O2/c1-27-24-14-8-13-21-22(24)15-16-25-23(21)17-18-26(28-25,19-9-4-2-5-10-19)20-11-6-3-7-12-20/h2-18H,1H3
InChIKeyOLXHXUMGPPZPEV-UHFFFAOYSA-N
MW364.44 g/mol
LogP6.20
Rot. Bonds3

About 7-methoxy-3,3-diphenylbenzo[f]chromene

7-methoxy-3,3-diphenylbenzo[f]chromene (PubChem CID 18954870) has the molecular formula C26H20O2 and a molecular weight of 364.44 g/mol. Its IUPAC name is 7-methoxy-3,3-diphenylbenzo[f]chromene.

Molecular Properties

Compound Name7-methoxy-3,3-diphenylbenzo[f]chromene
PubChem CID18954870
Molecular FormulaC26H20O2
Molecular Weight364.44 g/mol
Exact Mass364.15
IUPAC Name7-methoxy-3,3-diphenylbenzo[f]chromene
SMILESCOc1cccc2c3c(ccc12)OC(c1ccccc1)(c1ccccc1)C=C3
InChIInChI=1S/C26H20O2/c1-27-24-14-8-13-21-22(24)15-16-25-23(21)17-18-26(28-25,19-9-4-2-5-10-19)20-11-6-3-7-12-20/h2-18H,1H3
InChIKeyOLXHXUMGPPZPEV-UHFFFAOYSA-N
XLogP6.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.44
LogP ≤ 56.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-3,3-diphenylbenzo[f]chromene?
The IUPAC name of 7-methoxy-3,3-diphenylbenzo[f]chromene (CID 18954870) is 7-methoxy-3,3-diphenylbenzo[f]chromene.
What is the SMILES notation for 7-methoxy-3,3-diphenylbenzo[f]chromene?
The canonical SMILES for 7-methoxy-3,3-diphenylbenzo[f]chromene is COc1cccc2c3c(ccc12)OC(c1ccccc1)(c1ccccc1)C=C3.
What is the InChIKey of 7-methoxy-3,3-diphenylbenzo[f]chromene?
The InChIKey is OLXHXUMGPPZPEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20O2/c1-27-24-14-8-13-21-22(24)15-16-25-23(21)17-18-26(28-25,19-9-4-2-5-10-19)20-11-6-3-7-12-20/h2-18H,1H3.
What are the key properties of 7-methoxy-3,3-diphenylbenzo[f]chromene?
7-methoxy-3,3-diphenylbenzo[f]chromene has a molecular weight of 364.44 g/mol, XLogP of 6.20, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-3,3-diphenylbenzo[f]chromene is sourced from PubChem (CID 18954870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).