3,4-difluoro-3-methylpent-1-ene

C6H10F2 — CID 123355021

IUPAC3,4-difluoro-3-methylpent-1-ene
SMILESC=CC(C)(F)C(C)F
InChIInChI=1S/C6H10F2/c1-4-6(3,8)5(2)7/h4-5H,1H2,2-3H3
InChIKeyZWZOQBZAEMATOM-UHFFFAOYSA-N
MW120.14 g/mol
LogP2.26
Rot. Bonds2

About 3,4-difluoro-3-methylpent-1-ene

3,4-difluoro-3-methylpent-1-ene (PubChem CID 123355021) has the molecular formula C6H10F2 and a molecular weight of 120.14 g/mol. Its IUPAC name is 3,4-difluoro-3-methylpent-1-ene.

Molecular Properties

Compound Name3,4-difluoro-3-methylpent-1-ene
PubChem CID123355021
Molecular FormulaC6H10F2
Molecular Weight120.14 g/mol
Exact Mass120.08
IUPAC Name3,4-difluoro-3-methylpent-1-ene
SMILESC=CC(C)(F)C(C)F
InChIInChI=1S/C6H10F2/c1-4-6(3,8)5(2)7/h4-5H,1H2,2-3H3
InChIKeyZWZOQBZAEMATOM-UHFFFAOYSA-N
XLogP2.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.14
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethene;1,1,1-trifluoroethane
CID 175131333
3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene
CID 164994661
3,3-difluorobut-1-ene;propane
CID 143721745
3,3,3-trifluoroprop-1-ene
CID 90915807
1,1,1-trifluoroethane;1,1,2-trifluoroethane
CID 157050419
4,4-difluoro-2,2-dimethylhex-5-en-3-ol
CID 12591139
(3R)-5,5-difluoro-3-methylpent-1-ene
CID 137420018
3,3,4,4,5-pentamethylhex-1-ene
CID 23384855
3-fluoro-3-(fluoromethyl)-6-methyl-5-methylidenehept-1-ene
CID 143909189
3,4,4,5,6,6-hexafluorohept-1-ene
CID 141339436
3,3-dimethylbut-1-ene;2,2-dimethylpropane
CID 162278792
ethene;bis(2,2,5,5-tetramethylhex-3-ene)
CID 162279391

Frequently Asked Questions

What is the IUPAC name of 3,4-difluoro-3-methylpent-1-ene?
The IUPAC name of 3,4-difluoro-3-methylpent-1-ene (CID 123355021) is 3,4-difluoro-3-methylpent-1-ene.
What is the SMILES notation for 3,4-difluoro-3-methylpent-1-ene?
The canonical SMILES for 3,4-difluoro-3-methylpent-1-ene is C=CC(C)(F)C(C)F.
What is the InChIKey of 3,4-difluoro-3-methylpent-1-ene?
The InChIKey is ZWZOQBZAEMATOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2/c1-4-6(3,8)5(2)7/h4-5H,1H2,2-3H3.
What are the key properties of 3,4-difluoro-3-methylpent-1-ene?
3,4-difluoro-3-methylpent-1-ene has a molecular weight of 120.14 g/mol, XLogP of 2.26, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-difluoro-3-methylpent-1-ene is sourced from PubChem (CID 123355021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).