ethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene

C24H33F — CID 144909675

IUPACethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene
SMILESC=C.C=C(C)/C=C\C(=C)C(=C)CF.C=CC(=C)C(=C)/C=C\C(=C)CC
InChIInChI=1S/C12H16.C10H13F.C2H4/c1-6-10(3)8-9-12(5)11(4)7-2;1-8(2)5-6-9(3)10(4)7-11;1-2/h7-9H,2-6H2,1H3;5-6H,1,3-4,7H2,2H3;1-2H2/b9-8-;6-5-;
InChIKeyPPHBLYVWNMPLPV-UCOMPKPFSA-N
MW340.53 g/mol
LogP7.81
Rot. Bonds9

About ethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene

ethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene (PubChem CID 144909675) has the molecular formula C24H33F and a molecular weight of 340.53 g/mol. Its IUPAC name is ethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene.

Molecular Properties

Compound Nameethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene
PubChem CID144909675
Molecular FormulaC24H33F
Molecular Weight340.53 g/mol
Exact Mass340.26
IUPAC Nameethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene
SMILESC=C.C=C(C)/C=C\C(=C)C(=C)CF.C=CC(=C)C(=C)/C=C\C(=C)CC
InChIInChI=1S/C12H16.C10H13F.C2H4/c1-6-10(3)8-9-12(5)11(4)7-2;1-8(2)5-6-9(3)10(4)7-11;1-2/h7-9H,2-6H2,1H3;5-6H,1,3-4,7H2,2H3;1-2H2/b9-8-;6-5-;
InChIKeyPPHBLYVWNMPLPV-UCOMPKPFSA-N
XLogP7.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.53
LogP ≤ 57.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethene;(3Z,7Z)-2-methyl-5,6,9-trimethylideneundeca-1,3,7-triene
CID 145059823
(3Z,7Z)-2-methyl-5,6,9-trimethylideneundeca-1,3,7-triene;propane
CID 144723415
prop-1-ene;(4Z,8Z)-3,6,7,10-tetramethylidenedodeca-4,8-diene
CID 144612607
2,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene
CID 123828527
(3E,7Z)-5,6,9-trimethylidene-3-(trifluoromethyl)undeca-1,3,7-triene
CID 145480576
propane;(3Z,7Z)-5,6,9-trimethylideneundeca-1,3,7-trien-2-ol
CID 142281411
(Z)-5-methylidenehept-3-en-2-one
CID 123321874
(3Z,7Z,12Z)-2,14-dimethyl-5,6,10,11-tetramethylidenepentadeca-1,3,7,12,14-pentaene
CID 144536810
(Z)-2,3,6-trimethylidene-N-prop-1-en-2-yloct-4-en-1-imine
CID 145480541
(Z)-N-ethenyl-2,3,6-trimethylideneoct-4-en-1-imine
CID 145480572
2-methylbuta-1,3-diene;2-methylbut-1-ene
CID 160626231
(5Z)-2-fluoro-3,4,7-trimethylidenenona-1,5-diene;hydrofluoride
CID 143773200

Frequently Asked Questions

What is the IUPAC name of ethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene?
The IUPAC name of ethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene (CID 144909675) is ethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene.
What is the SMILES notation for ethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene?
The canonical SMILES for ethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene is C=C.C=C(C)/C=C\C(=C)C(=C)CF.C=CC(=C)C(=C)/C=C\C(=C)CC.
What is the InChIKey of ethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene?
The InChIKey is PPHBLYVWNMPLPV-UCOMPKPFSA-N. The full InChI is InChI=1S/C12H16.C10H13F.C2H4/c1-6-10(3)8-9-12(5)11(4)7-2;1-8(2)5-6-9(3)10(4)7-11;1-2/h7-9H,2-6H2,1H3;5-6H,1,3-4,7H2,2H3;1-2H2/b9-8-;6-5-;.
What are the key properties of ethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene?
ethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene has a molecular weight of 340.53 g/mol, XLogP of 7.81, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;(3Z)-6-(fluoromethyl)-2-methyl-5-methylidenehepta-1,3,6-triene;(5Z)-3,4,7-trimethylidenenona-1,5-diene is sourced from PubChem (CID 144909675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).