(Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene

C9H16F2 — CID 143009364

IUPAC(Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene
SMILESC/C(=C/C(C)C(C)CF)CF
InChIInChI=1S/C9H16F2/c1-7(5-10)4-8(2)9(3)6-11/h4,8-9H,5-6H2,1-3H3/b7-4-
InChIKeyPSNFMBNHWHFITK-DAXSKMNVSA-N
MW162.22 g/mol
LogP3.14
Rot. Bonds4

About (Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene

(Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene (PubChem CID 143009364) has the molecular formula C9H16F2 and a molecular weight of 162.22 g/mol. Its IUPAC name is (Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene.

Molecular Properties

Compound Name(Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene
PubChem CID143009364
Molecular FormulaC9H16F2
Molecular Weight162.22 g/mol
Exact Mass162.12
IUPAC Name(Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene
SMILESC/C(=C/C(C)C(C)CF)CF
InChIInChI=1S/C9H16F2/c1-7(5-10)4-8(2)9(3)6-11/h4,8-9H,5-6H2,1-3H3/b7-4-
InChIKeyPSNFMBNHWHFITK-DAXSKMNVSA-N
XLogP3.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.22
LogP ≤ 53.14
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

(Z)-1,3-difluoro-2-methylprop-1-ene
CID 18520934
(2S,3S)-2,3,5-trimethylhex-4-en-1-ol
CID 118549067
(Z)-2,4,5-trimethylhex-2-en-1-amine
CID 131259023
(Z)-1,1,1,4-tetrafluoro-3-methylbut-2-ene
CID 166805463
(2E,4E)-5-methyl-3-propan-2-ylhepta-2,4-dien-2-ol
CID 143347257
1-fluoro-2,4-dimethylhept-3-ene
CID 155390379
(3Z)-3,5,6-trimethylocta-1,3-diene
CID 165141677
(2Z,5Z)-8-fluoro-5,7-dimethylocta-2,5-diene
CID 143508838
[(2R,3R,4S)-1-iodo-2,4,6-trimethylhept-5-en-3-yl] acetate
CID 101266681
(Z)-2,4-dimethylhex-3-ene
CID 5463169
2,4-dimethylpent-2-en-1-ol
CID 54511819
(3S,4S)-4,7,8,10-tetramethylundec-9-en-3-ol
CID 54468843

Frequently Asked Questions

What is the IUPAC name of (Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene?
The IUPAC name of (Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene (CID 143009364) is (Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene.
What is the SMILES notation for (Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene?
The canonical SMILES for (Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene is C/C(=C/C(C)C(C)CF)CF.
What is the InChIKey of (Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene?
The InChIKey is PSNFMBNHWHFITK-DAXSKMNVSA-N. The full InChI is InChI=1S/C9H16F2/c1-7(5-10)4-8(2)9(3)6-11/h4,8-9H,5-6H2,1-3H3/b7-4-.
What are the key properties of (Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene?
(Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene has a molecular weight of 162.22 g/mol, XLogP of 3.14, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,6-difluoro-2,4,5-trimethylhex-2-ene is sourced from PubChem (CID 143009364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).