(9-methylxanthen-9-yl)methanol

C15H14O2 — CID 57435258

IUPAC(9-methylxanthen-9-yl)methanol
SMILESCC1(CO)c2ccccc2Oc2ccccc21
InChIInChI=1S/C15H14O2/c1-15(10-16)11-6-2-4-8-13(11)17-14-9-5-3-7-12(14)15/h2-9,16H,10H2,1H3
InChIKeyBTKYHZAFGMIFQP-UHFFFAOYSA-N
MW226.28 g/mol
LogP3.09
Rot. Bonds1

About (9-methylxanthen-9-yl)methanol

(9-methylxanthen-9-yl)methanol (PubChem CID 57435258) has the molecular formula C15H14O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is (9-methylxanthen-9-yl)methanol.

Molecular Properties

Compound Name(9-methylxanthen-9-yl)methanol
PubChem CID57435258
Molecular FormulaC15H14O2
Molecular Weight226.28 g/mol
Exact Mass226.10
IUPAC Name(9-methylxanthen-9-yl)methanol
SMILESCC1(CO)c2ccccc2Oc2ccccc21
InChIInChI=1S/C15H14O2/c1-15(10-16)11-6-2-4-8-13(11)17-14-9-5-3-7-12(14)15/h2-9,16H,10H2,1H3
InChIKeyBTKYHZAFGMIFQP-UHFFFAOYSA-N
XLogP3.09
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (9-methylxanthen-9-yl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (9-methylxanthen-9-yl)methanol?
The IUPAC name of (9-methylxanthen-9-yl)methanol (CID 57435258) is (9-methylxanthen-9-yl)methanol.
What is the SMILES notation for (9-methylxanthen-9-yl)methanol?
The canonical SMILES for (9-methylxanthen-9-yl)methanol is CC1(CO)c2ccccc2Oc2ccccc21.
What is the InChIKey of (9-methylxanthen-9-yl)methanol?
The InChIKey is BTKYHZAFGMIFQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O2/c1-15(10-16)11-6-2-4-8-13(11)17-14-9-5-3-7-12(14)15/h2-9,16H,10H2,1H3.
What are the key properties of (9-methylxanthen-9-yl)methanol?
(9-methylxanthen-9-yl)methanol has a molecular weight of 226.28 g/mol, XLogP of 3.09, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (9-methylxanthen-9-yl)methanol is sourced from PubChem (CID 57435258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).