4-methoxy-9,10-dihydrophenanthrene-2,7-diol

C15H14O3 — CID 11390848

IUPAC4-methoxy-9,10-dihydrophenanthrene-2,7-diol
SMILESCOc1cc(O)cc2c1-c1ccc(O)cc1CC2
InChIInChI=1S/C15H14O3/c1-18-14-8-12(17)7-10-3-2-9-6-11(16)4-5-13(9)15(10)14/h4-8,16-17H,2-3H2,1H3
InChIKeyOPPGAHUCKDKQJR-UHFFFAOYSA-N
MW242.27 g/mol
LogP2.87
Rot. Bonds1

About 4-methoxy-9,10-dihydrophenanthrene-2,7-diol

4-methoxy-9,10-dihydrophenanthrene-2,7-diol (PubChem CID 11390848) has the molecular formula C15H14O3 and a molecular weight of 242.27 g/mol. Its IUPAC name is 4-methoxy-9,10-dihydrophenanthrene-2,7-diol.

Molecular Properties

Compound Name4-methoxy-9,10-dihydrophenanthrene-2,7-diol
PubChem CID11390848
Molecular FormulaC15H14O3
Molecular Weight242.27 g/mol
Exact Mass242.09
IUPAC Name4-methoxy-9,10-dihydrophenanthrene-2,7-diol
SMILESCOc1cc(O)cc2c1-c1ccc(O)cc1CC2
InChIInChI=1S/C15H14O3/c1-18-14-8-12(17)7-10-3-2-9-6-11(16)4-5-13(9)15(10)14/h4-8,16-17H,2-3H2,1H3
InChIKeyOPPGAHUCKDKQJR-UHFFFAOYSA-N
XLogP2.87
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-9,10-dihydrophenanthrene-2,7-diol?
The IUPAC name of 4-methoxy-9,10-dihydrophenanthrene-2,7-diol (CID 11390848) is 4-methoxy-9,10-dihydrophenanthrene-2,7-diol.
What is the SMILES notation for 4-methoxy-9,10-dihydrophenanthrene-2,7-diol?
The canonical SMILES for 4-methoxy-9,10-dihydrophenanthrene-2,7-diol is COc1cc(O)cc2c1-c1ccc(O)cc1CC2.
What is the InChIKey of 4-methoxy-9,10-dihydrophenanthrene-2,7-diol?
The InChIKey is OPPGAHUCKDKQJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O3/c1-18-14-8-12(17)7-10-3-2-9-6-11(16)4-5-13(9)15(10)14/h4-8,16-17H,2-3H2,1H3.
What are the key properties of 4-methoxy-9,10-dihydrophenanthrene-2,7-diol?
4-methoxy-9,10-dihydrophenanthrene-2,7-diol has a molecular weight of 242.27 g/mol, XLogP of 2.87, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-9,10-dihydrophenanthrene-2,7-diol is sourced from PubChem (CID 11390848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).