1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene

C7H10F4O2 — CID 123221717

IUPAC1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene
SMILESCOC(=CC(CF)OC)C(F)(F)F
InChIInChI=1S/C7H10F4O2/c1-12-5(4-8)3-6(13-2)7(9,10)11/h3,5H,4H2,1-2H3
InChIKeyKWJQFNNIAZYDME-UHFFFAOYSA-N
MW202.15 g/mol
LogP2.06
Rot. Bonds4

About 1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene

1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene (PubChem CID 123221717) has the molecular formula C7H10F4O2 and a molecular weight of 202.15 g/mol. Its IUPAC name is 1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene.

Molecular Properties

Compound Name1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene
PubChem CID123221717
Molecular FormulaC7H10F4O2
Molecular Weight202.15 g/mol
Exact Mass202.06
IUPAC Name1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene
SMILESCOC(=CC(CF)OC)C(F)(F)F
InChIInChI=1S/C7H10F4O2/c1-12-5(4-8)3-6(13-2)7(9,10)11/h3,5H,4H2,1-2H3
InChIKeyKWJQFNNIAZYDME-UHFFFAOYSA-N
XLogP2.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.15
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

(Z)-1,1,1-trifluoro-2,4-dimethoxypent-2-ene
CID 89492384
1,1,1-Trifluoro-2,4-dimethoxypent-2-ene
CID 123570794
2-Ethoxy-1,5-difluoro-4-methoxypent-2-ene
CID 123798607
(Z)-2-(trifluoromethoxy)hex-3-ene
CID 132225971
(Z)-1,1,1,5,5,5-hexafluoro-4-methoxypent-2-en-2-ol
CID 154551546
(3E)-2-fluoro-3,5-dimethoxyhexa-1,3-diene
CID 156392854
(Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene
CID 162581011
1,1,1,2-Tetrafluoro-4-(1,1,2,2,3,3,3-heptafluoropropoxy)pent-2-ene
CID 175824425
4,4,5,5-Tetrafluoro-1,3-dimethoxycyclopentene
CID 21731922
(E)-4-[(Z)-1,2-difluoroethenoxy]pent-2-ene
CID 100949277
(Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxy-3-(trifluoromethyl)pent-2-ene
CID 102005779
(Z)-4-(trifluoromethoxy)pent-2-ene
CID 142930131

Frequently Asked Questions

What is the IUPAC name of 1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene?
The IUPAC name of 1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene (CID 123221717) is 1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene.
What is the SMILES notation for 1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene?
The canonical SMILES for 1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene is COC(=CC(CF)OC)C(F)(F)F.
What is the InChIKey of 1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene?
The InChIKey is KWJQFNNIAZYDME-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F4O2/c1-12-5(4-8)3-6(13-2)7(9,10)11/h3,5H,4H2,1-2H3.
What are the key properties of 1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene?
1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene has a molecular weight of 202.15 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,5-tetrafluoro-2,4-dimethoxypent-2-ene is sourced from PubChem (CID 123221717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).