3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol

C11H9F3O — CID 134966825

IUPAC3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol
SMILESC=C1CC(O)c2ccc(C(F)(F)F)cc21
InChIInChI=1S/C11H9F3O/c1-6-4-10(15)8-3-2-7(5-9(6)8)11(12,13)14/h2-3,5,10,15H,1,4H2
InChIKeyRSUHNAPEFHGGEC-UHFFFAOYSA-N
MW214.19 g/mol
LogP3.16
Rot. Bonds

About 3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol

3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol (PubChem CID 134966825) has the molecular formula C11H9F3O and a molecular weight of 214.19 g/mol. Its IUPAC name is 3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol.

Molecular Properties

Compound Name3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol
PubChem CID134966825
Molecular FormulaC11H9F3O
Molecular Weight214.19 g/mol
Exact Mass214.06
IUPAC Name3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol
SMILESC=C1CC(O)c2ccc(C(F)(F)F)cc21
InChIInChI=1S/C11H9F3O/c1-6-4-10(15)8-3-2-7(5-9(6)8)11(12,13)14/h2-3,5,10,15H,1,4H2
InChIKeyRSUHNAPEFHGGEC-UHFFFAOYSA-N
XLogP3.16
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.19
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Fluoren-9-ol
CID 74318
1-Indanol
CID 22819
3,4-Dimethylbenzyl alcohol
CID 23407
(1S)-2,3-dihydro-1H-inden-1-ol
CID 6971242
2,4-Dimethylbenzyl alcohol
CID 27809
(+-)-Acenaphthenol
CID 22750
1-Fluorenemethanol
CID 52307
(2,3-dihydro-1H-inden-5-yl)methanol
CID 330183
(1R)-2,3-dihydro-1H-inden-1-ol
CID 6971243
1-(2,4-Dimethylphenyl)ethanol
CID 21475
2-Phenyl-9-(trifluoromethyl)fluoren-9-ol
CID 59493041
Dehydrobotrydienol
CID 10728408

Frequently Asked Questions

What is the IUPAC name of 3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol?
The IUPAC name of 3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol (CID 134966825) is 3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol.
What is the SMILES notation for 3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol?
The canonical SMILES for 3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol is C=C1CC(O)c2ccc(C(F)(F)F)cc21.
What is the InChIKey of 3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol?
The InChIKey is RSUHNAPEFHGGEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F3O/c1-6-4-10(15)8-3-2-7(5-9(6)8)11(12,13)14/h2-3,5,10,15H,1,4H2.
What are the key properties of 3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol?
3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol has a molecular weight of 214.19 g/mol, XLogP of 3.16, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidene-5-(trifluoromethyl)-1,2-dihydroinden-1-ol is sourced from PubChem (CID 134966825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).