1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol

C10H11FO2 — CID 118282470

IUPAC1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol
SMILESOCc1ccc2c(c1)CCC2(O)F
InChIInChI=1S/C10H11FO2/c11-10(13)4-3-8-5-7(6-12)1-2-9(8)10/h1-2,5,12-13H,3-4,6H2
InChIKeyQWKCJJGEGJOGCN-UHFFFAOYSA-N
MW182.19 g/mol
LogP1.24
Rot. Bonds1

About 1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol

1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol (PubChem CID 118282470) has the molecular formula C10H11FO2 and a molecular weight of 182.19 g/mol. Its IUPAC name is 1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol.

Molecular Properties

Compound Name1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol
PubChem CID118282470
Molecular FormulaC10H11FO2
Molecular Weight182.19 g/mol
Exact Mass182.07
IUPAC Name1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol
SMILESOCc1ccc2c(c1)CCC2(O)F
InChIInChI=1S/C10H11FO2/c11-10(13)4-3-8-5-7(6-12)1-2-9(8)10/h1-2,5,12-13H,3-4,6H2
InChIKeyQWKCJJGEGJOGCN-UHFFFAOYSA-N
XLogP1.24
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.19
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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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
2,4,6-Trimethylbenzyl alcohol
CID 20139
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

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol?
The IUPAC name of 1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol (CID 118282470) is 1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol.
What is the SMILES notation for 1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol?
The canonical SMILES for 1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol is OCc1ccc2c(c1)CCC2(O)F.
What is the InChIKey of 1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol?
The InChIKey is QWKCJJGEGJOGCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO2/c11-10(13)4-3-8-5-7(6-12)1-2-9(8)10/h1-2,5,12-13H,3-4,6H2.
What are the key properties of 1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol?
1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol has a molecular weight of 182.19 g/mol, XLogP of 1.24, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-5-(hydroxymethyl)-2,3-dihydroinden-1-ol is sourced from PubChem (CID 118282470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).