(2R)-5,5-difluoro-2-prop-1-en-2-yloxane

C8H12F2O — CID 146433106

IUPAC(2R)-5,5-difluoro-2-prop-1-en-2-yloxane
SMILESC=C(C)[C@H]1CCC(F)(F)CO1
InChIInChI=1S/C8H12F2O/c1-6(2)7-3-4-8(9,10)5-11-7/h7H,1,3-5H2,2H3/t7-/m1/s1
InChIKeyVMIHQXGVWCCSLS-SSDOTTSWSA-N
MW162.18 g/mol
LogP2.38
Rot. Bonds1

About (2R)-5,5-difluoro-2-prop-1-en-2-yloxane

(2R)-5,5-difluoro-2-prop-1-en-2-yloxane (PubChem CID 146433106) has the molecular formula C8H12F2O and a molecular weight of 162.18 g/mol. Its IUPAC name is (2R)-5,5-difluoro-2-prop-1-en-2-yloxane.

Molecular Properties

Compound Name(2R)-5,5-difluoro-2-prop-1-en-2-yloxane
PubChem CID146433106
Molecular FormulaC8H12F2O
Molecular Weight162.18 g/mol
Exact Mass162.09
IUPAC Name(2R)-5,5-difluoro-2-prop-1-en-2-yloxane
SMILESC=C(C)[C@H]1CCC(F)(F)CO1
InChIInChI=1S/C8H12F2O/c1-6(2)7-3-4-8(9,10)5-11-7/h7H,1,3-5H2,2H3/t7-/m1/s1
InChIKeyVMIHQXGVWCCSLS-SSDOTTSWSA-N
XLogP2.38
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.18
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-Prop-1-en-2-yloxane
CID 68849969
2-Hept-1-en-2-yloxane
CID 70645400
2-But-1-en-2-yloxane
CID 70645401
5-Methylidene-2-pentyloxane
CID 118489514
1-Ethoxy-4-fluoro-2-methylidenecyclohexane
CID 91268962
1-Methylidene-2-(trifluoromethoxy)cyclohexane
CID 91431393
(4E)-4-(methoxymethylidene)-2-(2,2,2-trifluoroethyl)oxane
CID 118366658
(4Z)-4-(methoxymethylidene)-2-(2,2,2-trifluoroethyl)oxane
CID 118373698
4-(Methoxymethylidene)-2-(2,2,2-trifluoroethyl)oxane
CID 123552892
4-Methyl-2-(3,3,3-trifluoroprop-1-en-2-yl)oxane
CID 144656577
2-(3,3,3-Trifluoroprop-1-en-2-yl)oxan-4-ol
CID 144656581
4-(2,3-Dimethylidenehexoxy)-1,1-difluorocyclohexane
CID 170274165

Frequently Asked Questions

What is the IUPAC name of (2R)-5,5-difluoro-2-prop-1-en-2-yloxane?
The IUPAC name of (2R)-5,5-difluoro-2-prop-1-en-2-yloxane (CID 146433106) is (2R)-5,5-difluoro-2-prop-1-en-2-yloxane.
What is the SMILES notation for (2R)-5,5-difluoro-2-prop-1-en-2-yloxane?
The canonical SMILES for (2R)-5,5-difluoro-2-prop-1-en-2-yloxane is C=C(C)[C@H]1CCC(F)(F)CO1.
What is the InChIKey of (2R)-5,5-difluoro-2-prop-1-en-2-yloxane?
The InChIKey is VMIHQXGVWCCSLS-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H12F2O/c1-6(2)7-3-4-8(9,10)5-11-7/h7H,1,3-5H2,2H3/t7-/m1/s1.
What are the key properties of (2R)-5,5-difluoro-2-prop-1-en-2-yloxane?
(2R)-5,5-difluoro-2-prop-1-en-2-yloxane has a molecular weight of 162.18 g/mol, XLogP of 2.38, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5,5-difluoro-2-prop-1-en-2-yloxane is sourced from PubChem (CID 146433106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).