7-fluoro-3,4-dihydro-2H-chromen-8-ol

C9H9FO2 — CID 10630931

IUPAC7-fluoro-3,4-dihydro-2H-chromen-8-ol
SMILESOc1c(F)ccc2c1OCCC2
InChIInChI=1S/C9H9FO2/c10-7-4-3-6-2-1-5-12-9(6)8(7)11/h3-4,11H,1-2,5H2
InChIKeyPIFJVBIPGKERSO-UHFFFAOYSA-N
MW168.17 g/mol
LogP1.86
Rot. Bonds

About 7-fluoro-3,4-dihydro-2H-chromen-8-ol

7-fluoro-3,4-dihydro-2H-chromen-8-ol (PubChem CID 10630931) has the molecular formula C9H9FO2 and a molecular weight of 168.17 g/mol. Its IUPAC name is 7-fluoro-3,4-dihydro-2H-chromen-8-ol.

Molecular Properties

Compound Name7-fluoro-3,4-dihydro-2H-chromen-8-ol
PubChem CID10630931
Molecular FormulaC9H9FO2
Molecular Weight168.17 g/mol
Exact Mass168.06
IUPAC Name7-fluoro-3,4-dihydro-2H-chromen-8-ol
SMILESOc1c(F)ccc2c1OCCC2
InChIInChI=1S/C9H9FO2/c10-7-4-3-6-2-1-5-12-9(6)8(7)11/h3-4,11H,1-2,5H2
InChIKeyPIFJVBIPGKERSO-UHFFFAOYSA-N
XLogP1.86
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.17
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-fluoro-3,4-dihydro-2H-chromen-7-ol
CID 101361843
8-bromo-7-fluoro-3,4-dihydro-2H-chromene
CID 155778553
7-fluoro-3,4-dihydro-2H-chromene-8-carboxylic acid
CID 22404817
3-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)propanal
CID 117297394
2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol
CID 117301278
(1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine
CID 130845713
(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol
CID 117276567
[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclopropyl]methanamine
CID 117315960
8-fluoro-7-(trifluoromethyl)-3,4-dihydro-2H-chromene
CID 71065566
8-(2-fluorophenyl)-3,4-dihydro-2H-chromene;methanamine
CID 143567573
(4-chloro-2-fluorophenyl)-(3,4-dihydro-2H-chromen-8-yl)methanone
CID 114744096
[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine
CID 117413291

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-3,4-dihydro-2H-chromen-8-ol?
The IUPAC name of 7-fluoro-3,4-dihydro-2H-chromen-8-ol (CID 10630931) is 7-fluoro-3,4-dihydro-2H-chromen-8-ol.
What is the SMILES notation for 7-fluoro-3,4-dihydro-2H-chromen-8-ol?
The canonical SMILES for 7-fluoro-3,4-dihydro-2H-chromen-8-ol is Oc1c(F)ccc2c1OCCC2.
What is the InChIKey of 7-fluoro-3,4-dihydro-2H-chromen-8-ol?
The InChIKey is PIFJVBIPGKERSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FO2/c10-7-4-3-6-2-1-5-12-9(6)8(7)11/h3-4,11H,1-2,5H2.
What are the key properties of 7-fluoro-3,4-dihydro-2H-chromen-8-ol?
7-fluoro-3,4-dihydro-2H-chromen-8-ol has a molecular weight of 168.17 g/mol, XLogP of 1.86, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-3,4-dihydro-2H-chromen-8-ol is sourced from PubChem (CID 10630931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).