(2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium

C7H11F2OY- — CID 58988393

IUPAC(2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium
SMILESCC[C@H]1O[CH-]C(F)(F)[C@H]1C.[Y]
InChIInChI=1S/C7H11F2O.Y/c1-3-6-5(2)7(8,9)4-10-6;/h4-6H,3H2,1-2H3;/q-1;/t5-,6+;/m0./s1
InChIKeyVMJNXLLEQZZQSC-RIHPBJNCSA-N
MW238.07 g/mol
LogP2.23
Rot. Bonds1

About (2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium

(2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium (PubChem CID 58988393) has the molecular formula C7H11F2OY- and a molecular weight of 238.07 g/mol. Its IUPAC name is (2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium.

Molecular Properties

Compound Name(2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium
PubChem CID58988393
Molecular FormulaC7H11F2OY-
Molecular Weight238.07 g/mol
Exact Mass237.98
IUPAC Name(2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium
SMILESCC[C@H]1O[CH-]C(F)(F)[C@H]1C.[Y]
InChIInChI=1S/C7H11F2O.Y/c1-3-6-5(2)7(8,9)4-10-6;/h4-6H,3H2,1-2H3;/q-1;/t5-,6+;/m0./s1
InChIKeyVMJNXLLEQZZQSC-RIHPBJNCSA-N
XLogP2.23
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.07
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze (2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium with MolForge

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Launch Full Analysis

Related Compounds

2-Trifluoro-methyl-4-methyltetrahydropyran
CID 129270069
5-Ethyl-2,2,3,3,5-pentafluoro-4-(fluoromethyl)oxolane
CID 20725476
4,5-Bis(1,1-difluoroethyl)-2,3,3-trifluoro-2-(trifluoromethyl)oxolane
CID 20738948
2,5-Diethyl-3,4-bis(trifluoromethyl)oxolane
CID 20771104
2,5-Diethyl-3-(trifluoromethyl)oxolane
CID 20771105
2,2-Difluoro-3,5-dimethyloxolane
CID 20802266
2-(1,1,1,3,3,3-Hexafluoropropan-2-yl)oxolane
CID 21810349
2-Ethyl-4-fluoro-3,5-dimethyloxolane
CID 23557851
4-Ethyl-2-methyl-2-(trifluoromethyl)oxolane
CID 57682252
2-(1,1-Difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane
CID 58473338
2-Ethyl-3-(fluoromethyl)oxolane
CID 58612489
CID 58681794
CID 58681794

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium?
The IUPAC name of (2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium (CID 58988393) is (2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium.
What is the SMILES notation for (2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium?
The canonical SMILES for (2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium is CC[C@H]1O[CH-]C(F)(F)[C@H]1C.[Y].
What is the InChIKey of (2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium?
The InChIKey is VMJNXLLEQZZQSC-RIHPBJNCSA-N. The full InChI is InChI=1S/C7H11F2O.Y/c1-3-6-5(2)7(8,9)4-10-6;/h4-6H,3H2,1-2H3;/q-1;/t5-,6+;/m0./s1.
What are the key properties of (2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium?
(2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium has a molecular weight of 238.07 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2-ethyl-4,4-difluoro-3-methyl-3,5-dihydro-2H-furan-5-ide;yttrium is sourced from PubChem (CID 58988393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).