3-methoxy-9,10-dihydrophenanthrene-4,5-diol

C15H14O3 — CID 11499706

IUPAC3-methoxy-9,10-dihydrophenanthrene-4,5-diol
SMILESCOc1ccc2c(c1O)-c1c(O)cccc1CC2
InChIInChI=1S/C15H14O3/c1-18-12-8-7-10-6-5-9-3-2-4-11(16)13(9)14(10)15(12)17/h2-4,7-8,16-17H,5-6H2,1H3
InChIKeyLAUAVZVVTPWDRH-UHFFFAOYSA-N
MW242.27 g/mol
LogP2.87
Rot. Bonds1

About 3-methoxy-9,10-dihydrophenanthrene-4,5-diol

3-methoxy-9,10-dihydrophenanthrene-4,5-diol (PubChem CID 11499706) has the molecular formula C15H14O3 and a molecular weight of 242.27 g/mol. Its IUPAC name is 3-methoxy-9,10-dihydrophenanthrene-4,5-diol.

Molecular Properties

Compound Name3-methoxy-9,10-dihydrophenanthrene-4,5-diol
PubChem CID11499706
Molecular FormulaC15H14O3
Molecular Weight242.27 g/mol
Exact Mass242.09
IUPAC Name3-methoxy-9,10-dihydrophenanthrene-4,5-diol
SMILESCOc1ccc2c(c1O)-c1c(O)cccc1CC2
InChIInChI=1S/C15H14O3/c1-18-12-8-7-10-6-5-9-3-2-4-11(16)13(9)14(10)15(12)17/h2-4,7-8,16-17H,5-6H2,1H3
InChIKeyLAUAVZVVTPWDRH-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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Related Compounds

2-methoxy-9,10-dihydrophenanthrene-4,5-diol
CID 11506999
tricyclo[12.4.0.02,7]octadeca-1(14),2(7),3,5,15,17-hexaene-3,18-diol
CID 132501157
(3S)-5-methoxy-16-methyltricyclo[10.4.0.04,9]hexadeca-1(16),4(9),5,7,12,14-hexaene-2,3-diol
CID 158553914
1,10-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-11-ol
CID 162973167
2-(2,3-dihydro-1H-inden-2-yl)-4-hydroxy-5-methoxyisoindole-1,3-dione
CID 143767889
2-(1,2-dihydroacenaphthylen-5-yliminomethyl)-6-methoxyphenol
CID 4120706
ethane;4,5,9,10-tetrahydropyrene
CID 157285426
2,6-Dimethoxy-phenol boronic acid
CID 68597712
6-methoxy-1,2,3,4-tetrahydroisoquinolin-5-ol
CID 83875098
8-methoxy-1-methyl-3,4-dihydronaphthalene-2-carboxylic acid
CID 115057450
3-methoxy-9,10-dihydrophenanthren-2-ol
CID 14386782
1-[(3-amino-4-methoxyphenyl)methyl]-7-methoxy-3,4-dihydroisoquinolin-8-ol
CID 146161521

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-9,10-dihydrophenanthrene-4,5-diol?
The IUPAC name of 3-methoxy-9,10-dihydrophenanthrene-4,5-diol (CID 11499706) is 3-methoxy-9,10-dihydrophenanthrene-4,5-diol.
What is the SMILES notation for 3-methoxy-9,10-dihydrophenanthrene-4,5-diol?
The canonical SMILES for 3-methoxy-9,10-dihydrophenanthrene-4,5-diol is COc1ccc2c(c1O)-c1c(O)cccc1CC2.
What is the InChIKey of 3-methoxy-9,10-dihydrophenanthrene-4,5-diol?
The InChIKey is LAUAVZVVTPWDRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O3/c1-18-12-8-7-10-6-5-9-3-2-4-11(16)13(9)14(10)15(12)17/h2-4,7-8,16-17H,5-6H2,1H3.
What are the key properties of 3-methoxy-9,10-dihydrophenanthrene-4,5-diol?
3-methoxy-9,10-dihydrophenanthrene-4,5-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 3-methoxy-9,10-dihydrophenanthrene-4,5-diol is sourced from PubChem (CID 11499706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).