4-ethyl-9-(trifluoromethyl)fluoren-9-ol

C16H13F3O — CID 59493158

IUPAC4-ethyl-9-(trifluoromethyl)fluoren-9-ol
SMILESCCc1cccc2c1-c1ccccc1C2(O)C(F)(F)F
InChIInChI=1S/C16H13F3O/c1-2-10-6-5-9-13-14(10)11-7-3-4-8-12(11)15(13,20)16(17,18)19/h3-9,20H,2H2,1H3
InChIKeyRLBVZBFOTNDZQA-UHFFFAOYSA-N
MW278.27 g/mol
LogP4.03
Rot. Bonds1

About 4-ethyl-9-(trifluoromethyl)fluoren-9-ol

4-ethyl-9-(trifluoromethyl)fluoren-9-ol (PubChem CID 59493158) has the molecular formula C16H13F3O and a molecular weight of 278.27 g/mol. Its IUPAC name is 4-ethyl-9-(trifluoromethyl)fluoren-9-ol.

Molecular Properties

Compound Name4-ethyl-9-(trifluoromethyl)fluoren-9-ol
PubChem CID59493158
Molecular FormulaC16H13F3O
Molecular Weight278.27 g/mol
Exact Mass278.09
IUPAC Name4-ethyl-9-(trifluoromethyl)fluoren-9-ol
SMILESCCc1cccc2c1-c1ccccc1C2(O)C(F)(F)F
InChIInChI=1S/C16H13F3O/c1-2-10-6-5-9-13-14(10)11-7-3-4-8-12(11)15(13,20)16(17,18)19/h3-9,20H,2H2,1H3
InChIKeyRLBVZBFOTNDZQA-UHFFFAOYSA-N
XLogP4.03
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.27
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-9-(trifluoromethyl)fluoren-9-ol?
The IUPAC name of 4-ethyl-9-(trifluoromethyl)fluoren-9-ol (CID 59493158) is 4-ethyl-9-(trifluoromethyl)fluoren-9-ol.
What is the SMILES notation for 4-ethyl-9-(trifluoromethyl)fluoren-9-ol?
The canonical SMILES for 4-ethyl-9-(trifluoromethyl)fluoren-9-ol is CCc1cccc2c1-c1ccccc1C2(O)C(F)(F)F.
What is the InChIKey of 4-ethyl-9-(trifluoromethyl)fluoren-9-ol?
The InChIKey is RLBVZBFOTNDZQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F3O/c1-2-10-6-5-9-13-14(10)11-7-3-4-8-12(11)15(13,20)16(17,18)19/h3-9,20H,2H2,1H3.
What are the key properties of 4-ethyl-9-(trifluoromethyl)fluoren-9-ol?
4-ethyl-9-(trifluoromethyl)fluoren-9-ol has a molecular weight of 278.27 g/mol, XLogP of 4.03, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-9-(trifluoromethyl)fluoren-9-ol is sourced from PubChem (CID 59493158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).