(6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol

C10H11FO2 — CID 55252783

IUPAC(6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol
SMILESOCc1cc(F)cc2c1OCCC2
InChIInChI=1S/C10H11FO2/c11-9-4-7-2-1-3-13-10(7)8(5-9)6-12/h4-5,12H,1-3,6H2
InChIKeyMLKBJPCYHDAFNJ-UHFFFAOYSA-N
MW182.19 g/mol
LogP1.64
Rot. Bonds1

About (6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol

(6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol (PubChem CID 55252783) has the molecular formula C10H11FO2 and a molecular weight of 182.19 g/mol. Its IUPAC name is (6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol.

Molecular Properties

Compound Name(6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol
PubChem CID55252783
Molecular FormulaC10H11FO2
Molecular Weight182.19 g/mol
Exact Mass182.07
IUPAC Name(6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol
SMILESOCc1cc(F)cc2c1OCCC2
InChIInChI=1S/C10H11FO2/c11-9-4-7-2-1-3-13-10(7)8(5-9)6-12/h4-5,12H,1-3,6H2
InChIKeyMLKBJPCYHDAFNJ-UHFFFAOYSA-N
XLogP1.64
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.19
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol?
The IUPAC name of (6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol (CID 55252783) is (6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol.
What is the SMILES notation for (6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol?
The canonical SMILES for (6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol is OCc1cc(F)cc2c1OCCC2.
What is the InChIKey of (6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol?
The InChIKey is MLKBJPCYHDAFNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO2/c11-9-4-7-2-1-3-13-10(7)8(5-9)6-12/h4-5,12H,1-3,6H2.
What are the key properties of (6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol?
(6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol has a molecular weight of 182.19 g/mol, XLogP of 1.64, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-fluoro-3,4-dihydro-2H-chromen-8-yl)methanol is sourced from PubChem (CID 55252783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).