(2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol

C17H15FO2 — CID 142714174

IUPAC(2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol
SMILESO[C@H]1CC(C=Cc2ccc(F)cc2)c2ccccc2O1
InChIInChI=1S/C17H15FO2/c18-14-9-6-12(7-10-14)5-8-13-11-17(19)20-16-4-2-1-3-15(13)16/h1-10,13,17,19H,11H2/t13?,17-/m1/s1
InChIKeyCSCVHWGBIBOCPJ-LRHAYUFXSA-N
MW270.30 g/mol
LogP3.72
Rot. Bonds2

About (2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol

(2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol (PubChem CID 142714174) has the molecular formula C17H15FO2 and a molecular weight of 270.30 g/mol. Its IUPAC name is (2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol.

Molecular Properties

Compound Name(2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol
PubChem CID142714174
Molecular FormulaC17H15FO2
Molecular Weight270.30 g/mol
Exact Mass270.11
IUPAC Name(2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol
SMILESO[C@H]1CC(C=Cc2ccc(F)cc2)c2ccccc2O1
InChIInChI=1S/C17H15FO2/c18-14-9-6-12(7-10-14)5-8-13-11-17(19)20-16-4-2-1-3-15(13)16/h1-10,13,17,19H,11H2/t13?,17-/m1/s1
InChIKeyCSCVHWGBIBOCPJ-LRHAYUFXSA-N
XLogP3.72
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.30
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol?
The IUPAC name of (2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol (CID 142714174) is (2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol.
What is the SMILES notation for (2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol?
The canonical SMILES for (2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol is O[C@H]1CC(C=Cc2ccc(F)cc2)c2ccccc2O1.
What is the InChIKey of (2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol?
The InChIKey is CSCVHWGBIBOCPJ-LRHAYUFXSA-N. The full InChI is InChI=1S/C17H15FO2/c18-14-9-6-12(7-10-14)5-8-13-11-17(19)20-16-4-2-1-3-15(13)16/h1-10,13,17,19H,11H2/t13?,17-/m1/s1.
What are the key properties of (2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol?
(2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol has a molecular weight of 270.30 g/mol, XLogP of 3.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-[2-(4-fluorophenyl)ethenyl]-3,4-dihydro-2H-chromen-2-ol is sourced from PubChem (CID 142714174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).