(2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene

C15H8F4O — CID 168762994

IUPAC(2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene
SMILESFc1cc(F)c2c(c1)O[C@@H](c1ccc(F)c(F)c1)C=C2
InChIInChI=1S/C15H8F4O/c16-9-6-12(18)10-2-4-14(20-15(10)7-9)8-1-3-11(17)13(19)5-8/h1-7,14H/t14-/m1/s1
InChIKeyLMCPJIXTYBHGCO-CQSZACIVSA-N
MW280.22 g/mol
LogP4.39
Rot. Bonds1

About (2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene

(2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene (PubChem CID 168762994) has the molecular formula C15H8F4O and a molecular weight of 280.22 g/mol. Its IUPAC name is (2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene.

Molecular Properties

Compound Name(2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene
PubChem CID168762994
Molecular FormulaC15H8F4O
Molecular Weight280.22 g/mol
Exact Mass280.05
IUPAC Name(2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene
SMILESFc1cc(F)c2c(c1)O[C@@H](c1ccc(F)c(F)c1)C=C2
InChIInChI=1S/C15H8F4O/c16-9-6-12(18)10-2-4-14(20-15(10)7-9)8-1-3-11(17)13(19)5-8/h1-7,14H/t14-/m1/s1
InChIKeyLMCPJIXTYBHGCO-CQSZACIVSA-N
XLogP4.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.22
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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2-(3,4-difluorophenyl)oxolan-3-amine
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magnesium;hydride;1,2,4-trifluorobenzene
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2-(3,4-difluorophenyl)-2H-imidazole
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trans-(1S,2R)-2-(3,4-difluorophenyl)cyclopropan-1-amine;trans-(1R,2S)-2-(3,4-difluorophenyl)cyclopropan-1-amine
CID 154925657
2,3,5,7-tetrafluoro-2,3-dihydro-1,4-benzodioxine
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CID 123284155
2-(chloromethyl)-2-(3,4-difluorophenyl)-3-(4-fluorophenyl)oxirane
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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene?
The IUPAC name of (2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene (CID 168762994) is (2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene.
What is the SMILES notation for (2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene?
The canonical SMILES for (2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene is Fc1cc(F)c2c(c1)O[C@@H](c1ccc(F)c(F)c1)C=C2.
What is the InChIKey of (2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene?
The InChIKey is LMCPJIXTYBHGCO-CQSZACIVSA-N. The full InChI is InChI=1S/C15H8F4O/c16-9-6-12(18)10-2-4-14(20-15(10)7-9)8-1-3-11(17)13(19)5-8/h1-7,14H/t14-/m1/s1.
What are the key properties of (2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene?
(2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene has a molecular weight of 280.22 g/mol, XLogP of 4.39, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3,4-difluorophenyl)-5,7-difluoro-2H-chromene is sourced from PubChem (CID 168762994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).