2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane

C11H7ClF4O — CID 177481649

IUPAC2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane
SMILESC=C1OC(c2ccccc2Cl)C(F)(F)C1(F)F
InChIInChI=1S/C11H7ClF4O/c1-6-10(13,14)11(15,16)9(17-6)7-4-2-3-5-8(7)12/h2-5,9H,1H2
InChIKeyHBJQCXSRLJSLRB-UHFFFAOYSA-N
MW266.62 g/mol
LogP4.20
Rot. Bonds1

About 2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane

2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane (PubChem CID 177481649) has the molecular formula C11H7ClF4O and a molecular weight of 266.62 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane.

Molecular Properties

Compound Name2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane
PubChem CID177481649
Molecular FormulaC11H7ClF4O
Molecular Weight266.62 g/mol
Exact Mass266.01
IUPAC Name2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane
SMILESC=C1OC(c2ccccc2Cl)C(F)(F)C1(F)F
InChIInChI=1S/C11H7ClF4O/c1-6-10(13,14)11(15,16)9(17-6)7-4-2-3-5-8(7)12/h2-5,9H,1H2
InChIKeyHBJQCXSRLJSLRB-UHFFFAOYSA-N
XLogP4.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.62
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(2-bromo-2-fluorocyclopropyl)-2-chlorobenzene
CID 142772570
3-(2-chlorophenyl)-2-(4-fluorophenyl)-2-methyloxirane
CID 22364625
(2S)-2-(2-chlorophenyl)oxirane
CID 12561900
2-(chloromethyl)-3-(2-chlorophenyl)-2-(3,5-difluorophenyl)oxirane
CID 87251597
(2S,3S)-3-(2-chlorophenyl)-2-(4-fluorophenyl)oxirane-2-carbaldehyde
CID 14698971
5-(2-chlorophenyl)-2,4,4-trimethyl-1,2-oxazolidin-3-one
CID 23176760
2-[(2R,3S)-3-(2-chlorophenyl)-2-methyloxiran-2-yl]-4,4-dimethyl-5H-1,3-oxazole
CID 102510429
(4S,5S)-4-(2-chlorophenyl)-2,2,5-trimethyl-1,3-dioxolane
CID 118141605
1-[2-(bromomethyl)cyclopropyl]-2-chlorobenzene
CID 81351751
(2S,3S,4S)-3-chloro-2-(2-chlorophenyl)-3-nitro-2,4-dihydrochromen-4-ol
CID 46946639
7-(2-chlorophenyl)bicyclo[2.2.1]heptane
CID 10262419
4-acetyl-5-(2-chlorophenyl)oxolane-2,3-dione
CID 3397352

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane?
The IUPAC name of 2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane (CID 177481649) is 2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane.
What is the SMILES notation for 2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane?
The canonical SMILES for 2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane is C=C1OC(c2ccccc2Cl)C(F)(F)C1(F)F.
What is the InChIKey of 2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane?
The InChIKey is HBJQCXSRLJSLRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClF4O/c1-6-10(13,14)11(15,16)9(17-6)7-4-2-3-5-8(7)12/h2-5,9H,1H2.
What are the key properties of 2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane?
2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane has a molecular weight of 266.62 g/mol, XLogP of 4.20, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-3,3,4,4-tetrafluoro-5-methylideneoxolane is sourced from PubChem (CID 177481649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).