(9R,10S)-9,10-dihydrophenanthrene-9,10-diol

C14H12O2 — CID 818822

IUPAC(9R,10S)-9,10-dihydrophenanthrene-9,10-diol
SMILESO[C@@H]1c2ccccc2-c2ccccc2[C@@H]1O
InChIInChI=1S/C14H12O2/c15-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14(13)16/h1-8,13-16H/t13-,14+
InChIKeyMFXNBQWUTDDOKE-OKILXGFUSA-N
MW212.25 g/mol
LogP2.43
Rot. Bonds

About (9R,10S)-9,10-dihydrophenanthrene-9,10-diol

(9R,10S)-9,10-dihydrophenanthrene-9,10-diol (PubChem CID 818822) has the molecular formula C14H12O2 and a molecular weight of 212.25 g/mol. Its IUPAC name is (9R,10S)-9,10-dihydrophenanthrene-9,10-diol.

Molecular Properties

Compound Name(9R,10S)-9,10-dihydrophenanthrene-9,10-diol
PubChem CID818822
Molecular FormulaC14H12O2
Molecular Weight212.25 g/mol
Exact Mass212.08
IUPAC Name(9R,10S)-9,10-dihydrophenanthrene-9,10-diol
SMILESO[C@@H]1c2ccccc2-c2ccccc2[C@@H]1O
InChIInChI=1S/C14H12O2/c15-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14(13)16/h1-8,13-16H/t13-,14+
InChIKeyMFXNBQWUTDDOKE-OKILXGFUSA-N
XLogP2.43
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (9R,10S)-9,10-dihydrophenanthrene-9,10-diol?
The IUPAC name of (9R,10S)-9,10-dihydrophenanthrene-9,10-diol (CID 818822) is (9R,10S)-9,10-dihydrophenanthrene-9,10-diol.
What is the SMILES notation for (9R,10S)-9,10-dihydrophenanthrene-9,10-diol?
The canonical SMILES for (9R,10S)-9,10-dihydrophenanthrene-9,10-diol is O[C@@H]1c2ccccc2-c2ccccc2[C@@H]1O.
What is the InChIKey of (9R,10S)-9,10-dihydrophenanthrene-9,10-diol?
The InChIKey is MFXNBQWUTDDOKE-OKILXGFUSA-N. The full InChI is InChI=1S/C14H12O2/c15-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14(13)16/h1-8,13-16H/t13-,14+.
What are the key properties of (9R,10S)-9,10-dihydrophenanthrene-9,10-diol?
(9R,10S)-9,10-dihydrophenanthrene-9,10-diol has a molecular weight of 212.25 g/mol, XLogP of 2.43, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (9R,10S)-9,10-dihydrophenanthrene-9,10-diol is sourced from PubChem (CID 818822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).