ethane;9-methyl-3-methylidenexanthene

C17H18O — CID 54302034

IUPACethane;9-methyl-3-methylidenexanthene
SMILESC=c1ccc2c(c1)Oc1ccccc1C=2C.CC
InChIInChI=1S/C15H12O.C2H6/c1-10-7-8-13-11(2)12-5-3-4-6-14(12)16-15(13)9-10;1-2/h3-9H,1H2,2H3;1-2H3
InChIKeySEXALGLGPDYRLJ-UHFFFAOYSA-N
MW238.33 g/mol
LogP3.45
Rot. Bonds

About ethane;9-methyl-3-methylidenexanthene

ethane;9-methyl-3-methylidenexanthene (PubChem CID 54302034) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is ethane;9-methyl-3-methylidenexanthene.

Molecular Properties

Compound Nameethane;9-methyl-3-methylidenexanthene
PubChem CID54302034
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Nameethane;9-methyl-3-methylidenexanthene
SMILESC=c1ccc2c(c1)Oc1ccccc1C=2C.CC
InChIInChI=1S/C15H12O.C2H6/c1-10-7-8-13-11(2)12-5-3-4-6-14(12)16-15(13)9-10;1-2/h3-9H,1H2,2H3;1-2H3
InChIKeySEXALGLGPDYRLJ-UHFFFAOYSA-N
XLogP3.45
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;9-methyl-3-methylidenexanthene?
The IUPAC name of ethane;9-methyl-3-methylidenexanthene (CID 54302034) is ethane;9-methyl-3-methylidenexanthene.
What is the SMILES notation for ethane;9-methyl-3-methylidenexanthene?
The canonical SMILES for ethane;9-methyl-3-methylidenexanthene is C=c1ccc2c(c1)Oc1ccccc1C=2C.CC.
What is the InChIKey of ethane;9-methyl-3-methylidenexanthene?
The InChIKey is SEXALGLGPDYRLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12O.C2H6/c1-10-7-8-13-11(2)12-5-3-4-6-14(12)16-15(13)9-10;1-2/h3-9H,1H2,2H3;1-2H3.
What are the key properties of ethane;9-methyl-3-methylidenexanthene?
ethane;9-methyl-3-methylidenexanthene has a molecular weight of 238.33 g/mol, XLogP of 3.45, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;9-methyl-3-methylidenexanthene is sourced from PubChem (CID 54302034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).