4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol

C14H7ClF4O — CID 59492689

IUPAC4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol
SMILESOC1(C(F)(F)F)c2ccccc2-c2c(Cl)cc(F)cc21
InChIInChI=1S/C14H7ClF4O/c15-11-6-7(16)5-10-12(11)8-3-1-2-4-9(8)13(10,20)14(17,18)19/h1-6,20H
InChIKeyXSLCFFOMHATYNA-UHFFFAOYSA-N
MW302.65 g/mol
LogP4.26
Rot. Bonds

About 4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol

4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol (PubChem CID 59492689) has the molecular formula C14H7ClF4O and a molecular weight of 302.65 g/mol. Its IUPAC name is 4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol.

Molecular Properties

Compound Name4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol
PubChem CID59492689
Molecular FormulaC14H7ClF4O
Molecular Weight302.65 g/mol
Exact Mass302.01
IUPAC Name4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol
SMILESOC1(C(F)(F)F)c2ccccc2-c2c(Cl)cc(F)cc21
InChIInChI=1S/C14H7ClF4O/c15-11-6-7(16)5-10-12(11)8-3-1-2-4-9(8)13(10,20)14(17,18)19/h1-6,20H
InChIKeyXSLCFFOMHATYNA-UHFFFAOYSA-N
XLogP4.26
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.65
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol?
The IUPAC name of 4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol (CID 59492689) is 4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol.
What is the SMILES notation for 4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol?
The canonical SMILES for 4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol is OC1(C(F)(F)F)c2ccccc2-c2c(Cl)cc(F)cc21.
What is the InChIKey of 4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol?
The InChIKey is XSLCFFOMHATYNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H7ClF4O/c15-11-6-7(16)5-10-12(11)8-3-1-2-4-9(8)13(10,20)14(17,18)19/h1-6,20H.
What are the key properties of 4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol?
4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol has a molecular weight of 302.65 g/mol, XLogP of 4.26, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-fluoro-9-(trifluoromethyl)fluoren-9-ol is sourced from PubChem (CID 59492689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).