3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol

C20H18O3 — CID 154968471

IUPAC3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol
SMILESCC1=C(c2ccccc2)c2cc3c(C)coc3c(C)c2OC1O
InChIInChI=1S/C20H18O3/c1-11-10-22-18-13(3)19-16(9-15(11)18)17(12(2)20(21)23-19)14-7-5-4-6-8-14/h4-10,20-21H,1-3H3
InChIKeyBEURHXVXMUTBOW-UHFFFAOYSA-N
MW306.36 g/mol
LogP4.58
Rot. Bonds1

About 3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol

3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol (PubChem CID 154968471) has the molecular formula C20H18O3 and a molecular weight of 306.36 g/mol. Its IUPAC name is 3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol.

Molecular Properties

Compound Name3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol
PubChem CID154968471
Molecular FormulaC20H18O3
Molecular Weight306.36 g/mol
Exact Mass306.13
IUPAC Name3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol
SMILESCC1=C(c2ccccc2)c2cc3c(C)coc3c(C)c2OC1O
InChIInChI=1S/C20H18O3/c1-11-10-22-18-13(3)19-16(9-15(11)18)17(12(2)20(21)23-19)14-7-5-4-6-8-14/h4-10,20-21H,1-3H3
InChIKeyBEURHXVXMUTBOW-UHFFFAOYSA-N
XLogP4.58
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.36
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol?
The IUPAC name of 3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol (CID 154968471) is 3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol.
What is the SMILES notation for 3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol?
The canonical SMILES for 3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol is CC1=C(c2ccccc2)c2cc3c(C)coc3c(C)c2OC1O.
What is the InChIKey of 3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol?
The InChIKey is BEURHXVXMUTBOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18O3/c1-11-10-22-18-13(3)19-16(9-15(11)18)17(12(2)20(21)23-19)14-7-5-4-6-8-14/h4-10,20-21H,1-3H3.
What are the key properties of 3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol?
3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol has a molecular weight of 306.36 g/mol, XLogP of 4.58, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6,9-trimethyl-5-phenyl-7H-furo[3,2-g]chromen-7-ol is sourced from PubChem (CID 154968471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).