2-(fluoromethyl)-1,3-dihydroinden-2-ol

C10H11FO — CID 142216593

IUPAC2-(fluoromethyl)-1,3-dihydroinden-2-ol
SMILESOC1(CF)Cc2ccccc2C1
InChIInChI=1S/C10H11FO/c11-7-10(12)5-8-3-1-2-4-9(8)6-10/h1-4,12H,5-7H2
InChIKeySHFCYUIWCQDWRB-UHFFFAOYSA-N
MW166.20 g/mol
LogP1.49
Rot. Bonds1

About 2-(fluoromethyl)-1,3-dihydroinden-2-ol

2-(fluoromethyl)-1,3-dihydroinden-2-ol (PubChem CID 142216593) has the molecular formula C10H11FO and a molecular weight of 166.20 g/mol. Its IUPAC name is 2-(fluoromethyl)-1,3-dihydroinden-2-ol.

Molecular Properties

Compound Name2-(fluoromethyl)-1,3-dihydroinden-2-ol
PubChem CID142216593
Molecular FormulaC10H11FO
Molecular Weight166.20 g/mol
Exact Mass166.08
IUPAC Name2-(fluoromethyl)-1,3-dihydroinden-2-ol
SMILESOC1(CF)Cc2ccccc2C1
InChIInChI=1S/C10H11FO/c11-7-10(12)5-8-3-1-2-4-9(8)6-10/h1-4,12H,5-7H2
InChIKeySHFCYUIWCQDWRB-UHFFFAOYSA-N
XLogP1.49
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-1,3-dihydroinden-2-ol?
The IUPAC name of 2-(fluoromethyl)-1,3-dihydroinden-2-ol (CID 142216593) is 2-(fluoromethyl)-1,3-dihydroinden-2-ol.
What is the SMILES notation for 2-(fluoromethyl)-1,3-dihydroinden-2-ol?
The canonical SMILES for 2-(fluoromethyl)-1,3-dihydroinden-2-ol is OC1(CF)Cc2ccccc2C1.
What is the InChIKey of 2-(fluoromethyl)-1,3-dihydroinden-2-ol?
The InChIKey is SHFCYUIWCQDWRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO/c11-7-10(12)5-8-3-1-2-4-9(8)6-10/h1-4,12H,5-7H2.
What are the key properties of 2-(fluoromethyl)-1,3-dihydroinden-2-ol?
2-(fluoromethyl)-1,3-dihydroinden-2-ol has a molecular weight of 166.20 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-1,3-dihydroinden-2-ol is sourced from PubChem (CID 142216593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).