2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene

C15H18O2 — CID 89002724

IUPAC2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene
SMILESC=C1CC(C)C2C=c3cc(C)oc3=C(C)C2O1
InChIInChI=1S/C15H18O2/c1-8-5-9(2)17-15-11(4)14-12(7-13(8)15)6-10(3)16-14/h6-8,13,15H,2,5H2,1,3-4H3
InChIKeyIESROZSZUYGJGO-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.11
Rot. Bonds

About 2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene

2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene (PubChem CID 89002724) has the molecular formula C15H18O2 and a molecular weight of 230.31 g/mol. Its IUPAC name is 2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene.

Molecular Properties

Compound Name2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene
PubChem CID89002724
Molecular FormulaC15H18O2
Molecular Weight230.31 g/mol
Exact Mass230.13
IUPAC Name2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene
SMILESC=C1CC(C)C2C=c3cc(C)oc3=C(C)C2O1
InChIInChI=1S/C15H18O2/c1-8-5-9(2)17-15-11(4)14-12(7-13(8)15)6-10(3)16-14/h6-8,13,15H,2,5H2,1,3-4H3
InChIKeyIESROZSZUYGJGO-UHFFFAOYSA-N
XLogP2.11
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene?
The IUPAC name of 2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene (CID 89002724) is 2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene.
What is the SMILES notation for 2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene?
The canonical SMILES for 2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene is C=C1CC(C)C2C=c3cc(C)oc3=C(C)C2O1.
What is the InChIKey of 2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene?
The InChIKey is IESROZSZUYGJGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O2/c1-8-5-9(2)17-15-11(4)14-12(7-13(8)15)6-10(3)16-14/h6-8,13,15H,2,5H2,1,3-4H3.
What are the key properties of 2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene?
2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene has a molecular weight of 230.31 g/mol, XLogP of 2.11, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5,9-trimethyl-7-methylidene-4a,5,6,8a-tetrahydrofuro[3,2-g]chromene is sourced from PubChem (CID 89002724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).