3-methoxy-9-(trifluoromethyl)fluoren-9-ol

C15H11F3O2 — CID 59492487

IUPAC3-methoxy-9-(trifluoromethyl)fluoren-9-ol
SMILESCOc1ccc2c(c1)-c1ccccc1C2(O)C(F)(F)F
InChIInChI=1S/C15H11F3O2/c1-20-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14(13,19)15(16,17)18/h2-8,19H,1H3
InChIKeyJNCPKFWOLALYAO-UHFFFAOYSA-N
MW280.25 g/mol
LogP3.47
Rot. Bonds1

About 3-methoxy-9-(trifluoromethyl)fluoren-9-ol

3-methoxy-9-(trifluoromethyl)fluoren-9-ol (PubChem CID 59492487) has the molecular formula C15H11F3O2 and a molecular weight of 280.25 g/mol. Its IUPAC name is 3-methoxy-9-(trifluoromethyl)fluoren-9-ol.

Molecular Properties

Compound Name3-methoxy-9-(trifluoromethyl)fluoren-9-ol
PubChem CID59492487
Molecular FormulaC15H11F3O2
Molecular Weight280.25 g/mol
Exact Mass280.07
IUPAC Name3-methoxy-9-(trifluoromethyl)fluoren-9-ol
SMILESCOc1ccc2c(c1)-c1ccccc1C2(O)C(F)(F)F
InChIInChI=1S/C15H11F3O2/c1-20-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14(13,19)15(16,17)18/h2-8,19H,1H3
InChIKeyJNCPKFWOLALYAO-UHFFFAOYSA-N
XLogP3.47
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.25
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-4-(3,5-difluorophenoxy)-7-(trifluoromethyl)-2,3-dihydro-1H-inden-1-ol
CID 122506276
2-(4-Hydroxybutoxy)-9-(trifluoromethyl)fluoren-9-ol
CID 59492658
(8R,9S,13S,14S,17R)-3-methoxy-13-methyl-17-[(E)-5,5,6,6,7,7,8,8,9,9,10,10,10-tridecafluorodec-2-enyl]-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol
CID 49782554
4-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxybutanoic acid
CID 59492679
Ethyl 5-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypentanoate
CID 59492500
2-[3-(Dimethylamino)propoxy]-9-(trifluoromethyl)fluoren-9-ol
CID 59492528
2-Hexoxy-9-(trifluoromethyl)fluoren-9-ol
CID 59492533
5-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxypentanoic acid
CID 59492626
2-Butoxy-9-(trifluoromethyl)fluoren-9-ol
CID 59492669
Ethyl 4-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxybutanoate
CID 59492815
2-(5-Hydroxypentoxy)-9-(trifluoromethyl)fluoren-9-ol
CID 59492843
2-(6-Hydroxyhexoxy)-9-(trifluoromethyl)fluoren-9-ol
CID 59492866

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-9-(trifluoromethyl)fluoren-9-ol?
The IUPAC name of 3-methoxy-9-(trifluoromethyl)fluoren-9-ol (CID 59492487) is 3-methoxy-9-(trifluoromethyl)fluoren-9-ol.
What is the SMILES notation for 3-methoxy-9-(trifluoromethyl)fluoren-9-ol?
The canonical SMILES for 3-methoxy-9-(trifluoromethyl)fluoren-9-ol is COc1ccc2c(c1)-c1ccccc1C2(O)C(F)(F)F.
What is the InChIKey of 3-methoxy-9-(trifluoromethyl)fluoren-9-ol?
The InChIKey is JNCPKFWOLALYAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F3O2/c1-20-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14(13,19)15(16,17)18/h2-8,19H,1H3.
What are the key properties of 3-methoxy-9-(trifluoromethyl)fluoren-9-ol?
3-methoxy-9-(trifluoromethyl)fluoren-9-ol has a molecular weight of 280.25 g/mol, XLogP of 3.47, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-9-(trifluoromethyl)fluoren-9-ol is sourced from PubChem (CID 59492487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).