3,4,4-trifluoro-2,3-dimethylpent-1-ene

C7H11F3 — CID 123610200

IUPAC3,4,4-trifluoro-2,3-dimethylpent-1-ene
SMILESC=C(C)C(C)(F)C(C)(F)F
InChIInChI=1S/C7H11F3/c1-5(2)6(3,8)7(4,9)10/h1H2,2-4H3
InChIKeyUWAVXZPHSZJHFT-UHFFFAOYSA-N
MW152.16 g/mol
LogP2.95
Rot. Bonds2

About 3,4,4-trifluoro-2,3-dimethylpent-1-ene

3,4,4-trifluoro-2,3-dimethylpent-1-ene (PubChem CID 123610200) has the molecular formula C7H11F3 and a molecular weight of 152.16 g/mol. Its IUPAC name is 3,4,4-trifluoro-2,3-dimethylpent-1-ene.

Molecular Properties

Compound Name3,4,4-trifluoro-2,3-dimethylpent-1-ene
PubChem CID123610200
Molecular FormulaC7H11F3
Molecular Weight152.16 g/mol
Exact Mass152.08
IUPAC Name3,4,4-trifluoro-2,3-dimethylpent-1-ene
SMILESC=C(C)C(C)(F)C(C)(F)F
InChIInChI=1S/C7H11F3/c1-5(2)6(3,8)7(4,9)10/h1H2,2-4H3
InChIKeyUWAVXZPHSZJHFT-UHFFFAOYSA-N
XLogP2.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.16
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,4,4-trifluoro-2,3-dimethylpent-1-ene?
The IUPAC name of 3,4,4-trifluoro-2,3-dimethylpent-1-ene (CID 123610200) is 3,4,4-trifluoro-2,3-dimethylpent-1-ene.
What is the SMILES notation for 3,4,4-trifluoro-2,3-dimethylpent-1-ene?
The canonical SMILES for 3,4,4-trifluoro-2,3-dimethylpent-1-ene is C=C(C)C(C)(F)C(C)(F)F.
What is the InChIKey of 3,4,4-trifluoro-2,3-dimethylpent-1-ene?
The InChIKey is UWAVXZPHSZJHFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3/c1-5(2)6(3,8)7(4,9)10/h1H2,2-4H3.
What are the key properties of 3,4,4-trifluoro-2,3-dimethylpent-1-ene?
3,4,4-trifluoro-2,3-dimethylpent-1-ene has a molecular weight of 152.16 g/mol, XLogP of 2.95, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,4-trifluoro-2,3-dimethylpent-1-ene is sourced from PubChem (CID 123610200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).