8-fluoro-5-methyl-3,4-dihydro-2H-chromene

C10H11FO — CID 66604057

IUPAC8-fluoro-5-methyl-3,4-dihydro-2H-chromene
SMILESCc1ccc(F)c2c1CCCO2
InChIInChI=1S/C10H11FO/c1-7-4-5-9(11)10-8(7)3-2-6-12-10/h4-5H,2-3,6H2,1H3
InChIKeyLZOZJWGPUDSKFN-UHFFFAOYSA-N
MW166.19 g/mol
LogP2.46
Rot. Bonds

About 8-fluoro-5-methyl-3,4-dihydro-2H-chromene

8-fluoro-5-methyl-3,4-dihydro-2H-chromene (PubChem CID 66604057) has the molecular formula C10H11FO and a molecular weight of 166.19 g/mol. Its IUPAC name is 8-fluoro-5-methyl-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name8-fluoro-5-methyl-3,4-dihydro-2H-chromene
PubChem CID66604057
Molecular FormulaC10H11FO
Molecular Weight166.19 g/mol
Exact Mass166.08
IUPAC Name8-fluoro-5-methyl-3,4-dihydro-2H-chromene
SMILESCc1ccc(F)c2c1CCCO2
InChIInChI=1S/C10H11FO/c1-7-4-5-9(11)10-8(7)3-2-6-12-10/h4-5H,2-3,6H2,1H3
InChIKeyLZOZJWGPUDSKFN-UHFFFAOYSA-N
XLogP2.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.19
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-fluoro-5-methyl-3,4-dihydro-2H-chromene?
The IUPAC name of 8-fluoro-5-methyl-3,4-dihydro-2H-chromene (CID 66604057) is 8-fluoro-5-methyl-3,4-dihydro-2H-chromene.
What is the SMILES notation for 8-fluoro-5-methyl-3,4-dihydro-2H-chromene?
The canonical SMILES for 8-fluoro-5-methyl-3,4-dihydro-2H-chromene is Cc1ccc(F)c2c1CCCO2.
What is the InChIKey of 8-fluoro-5-methyl-3,4-dihydro-2H-chromene?
The InChIKey is LZOZJWGPUDSKFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO/c1-7-4-5-9(11)10-8(7)3-2-6-12-10/h4-5H,2-3,6H2,1H3.
What are the key properties of 8-fluoro-5-methyl-3,4-dihydro-2H-chromene?
8-fluoro-5-methyl-3,4-dihydro-2H-chromene has a molecular weight of 166.19 g/mol, XLogP of 2.46, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-5-methyl-3,4-dihydro-2H-chromene is sourced from PubChem (CID 66604057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).