8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene

C12H15FO — CID 89290968

IUPAC8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene
SMILESCC(C)c1cc(F)c2c(c1)CCCO2
InChIInChI=1S/C12H15FO/c1-8(2)10-6-9-4-3-5-14-12(9)11(13)7-10/h6-8H,3-5H2,1-2H3
InChIKeyMFBAGBLTDACMSX-UHFFFAOYSA-N
MW194.25 g/mol
LogP3.27
Rot. Bonds1

About 8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene

8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene (PubChem CID 89290968) has the molecular formula C12H15FO and a molecular weight of 194.25 g/mol. Its IUPAC name is 8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene
PubChem CID89290968
Molecular FormulaC12H15FO
Molecular Weight194.25 g/mol
Exact Mass194.11
IUPAC Name8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene
SMILESCC(C)c1cc(F)c2c(c1)CCCO2
InChIInChI=1S/C12H15FO/c1-8(2)10-6-9-4-3-5-14-12(9)11(13)7-10/h6-8H,3-5H2,1-2H3
InChIKeyMFBAGBLTDACMSX-UHFFFAOYSA-N
XLogP3.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

8-fluoro-N-propan-2-yl-3,4-dihydro-2H-chromen-6-amine
CID 71173446
6,8-difluoro-3,4-dihydro-2H-chromene
CID 69010256
8-fluoro-N-methyl-3,4-dihydro-2H-chromen-6-amine
CID 89390104
3-methyl-1-(7-propan-2-yl-2,3,4,5-tetrahydro-1-benzoxepin-9-yl)butan-1-one
CID 82247991
1-(9-fluoro-2,3,4,5-tetrahydro-1-benzoxepin-7-yl)-3-methylbutan-1-one
CID 82244841
5,7-difluoro-2,3-dihydro-1-benzofuran
CID 2736964
1-chloro-4-propan-2-ylbenzene;8-fluoro-5-methyl-6-propan-2-yl-3,4-dihydro-2H-chromene;methane;6-propan-2-yl-2,3-dihydro-1,4-benzodioxine;6-propan-2-yl-3,4-dihydro-2H-chromene
CID 162052106
(1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine
CID 130845713
ethane;7-fluoro-5-methyl-2,3-dihydro-1-benzofuran
CID 177214189
(2S)-2-(8-fluoro-3,4-dihydro-2H-chromen-6-yl)pyrrolidine
CID 66519309
1-(2,3,4,7,8,9-hexahydropyrano[2,3-g]chromen-5-yl)ethanamine
CID 115010138
butane;5-ethyl-7-fluoro-2,3-dihydro-1-benzofuran
CID 143668070

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene?
The IUPAC name of 8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene (CID 89290968) is 8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene.
What is the SMILES notation for 8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene?
The canonical SMILES for 8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene is CC(C)c1cc(F)c2c(c1)CCCO2.
What is the InChIKey of 8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene?
The InChIKey is MFBAGBLTDACMSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FO/c1-8(2)10-6-9-4-3-5-14-12(9)11(13)7-10/h6-8H,3-5H2,1-2H3.
What are the key properties of 8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene?
8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene has a molecular weight of 194.25 g/mol, XLogP of 3.27, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-6-propan-2-yl-3,4-dihydro-2H-chromene is sourced from PubChem (CID 89290968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).