2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol

C17H15F3O2 — CID 59492791

IUPAC2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol
SMILESCC(C)Oc1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C17H15F3O2/c1-10(2)22-11-7-8-13-12-5-3-4-6-14(12)16(21,15(13)9-11)17(18,19)20/h3-10,21H,1-2H3
InChIKeyBFAGSEHHHZTIGZ-UHFFFAOYSA-N
MW308.30 g/mol
LogP4.25
Rot. Bonds2

About 2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol

2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol (PubChem CID 59492791) has the molecular formula C17H15F3O2 and a molecular weight of 308.30 g/mol. Its IUPAC name is 2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol.

Molecular Properties

Compound Name2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol
PubChem CID59492791
Molecular FormulaC17H15F3O2
Molecular Weight308.30 g/mol
Exact Mass308.10
IUPAC Name2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol
SMILESCC(C)Oc1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2
InChIInChI=1S/C17H15F3O2/c1-10(2)22-11-7-8-13-12-5-3-4-6-14(12)16(21,15(13)9-11)17(18,19)20/h3-10,21H,1-2H3
InChIKeyBFAGSEHHHZTIGZ-UHFFFAOYSA-N
XLogP4.25
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.30
LogP ≤ 54.25
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
(6aS,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromene-6a,9-diol
CID 57403753
1-[3-[[2-(Hydroxymethyl)phenyl]methoxy]phenyl]pentan-1-ol
CID 44265504
4-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxybutanoic acid
CID 59492679
tert-butyl N-[2-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyethyl]-N-methylcarbamate
CID 59492476
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
3-[9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxy-N,N-dimethylpropanamide
CID 59492562
2-[9-Hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxyacetamide
CID 59492583

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol?
The IUPAC name of 2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol (CID 59492791) is 2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol.
What is the SMILES notation for 2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol?
The canonical SMILES for 2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol is CC(C)Oc1ccc2c(c1)C(O)(C(F)(F)F)c1ccccc1-2.
What is the InChIKey of 2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol?
The InChIKey is BFAGSEHHHZTIGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F3O2/c1-10(2)22-11-7-8-13-12-5-3-4-6-14(12)16(21,15(13)9-11)17(18,19)20/h3-10,21H,1-2H3.
What are the key properties of 2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol?
2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol has a molecular weight of 308.30 g/mol, XLogP of 4.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yloxy-9-(trifluoromethyl)fluoren-9-ol is sourced from PubChem (CID 59492791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).