ethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane

C24H42 — CID 144537696

IUPACethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane
SMILESC=C(/C=C\C)C(C)=C(C=C(C)C)C(/C=C\C)=C(C)C.CC.CCC
InChIInChI=1S/C19H28.C3H8.C2H6/c1-9-11-16(7)17(8)19(13-14(3)4)18(12-10-2)15(5)6;1-3-2;1-2/h9-13H,7H2,1-6,8H3;3H2,1-2H3;1-2H3/b11-9-,12-10-,19-17-;;
InChIKeyUPMDNPOFOUVTAF-IIZTZMOZSA-N
MW330.60 g/mol
LogP8.76
Rot. Bonds5

About ethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane

ethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane (PubChem CID 144537696) has the molecular formula C24H42 and a molecular weight of 330.60 g/mol. Its IUPAC name is ethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane.

Molecular Properties

Compound Nameethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane
PubChem CID144537696
Molecular FormulaC24H42
Molecular Weight330.60 g/mol
Exact Mass330.33
IUPAC Nameethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane
SMILESC=C(/C=C\C)C(C)=C(C=C(C)C)C(/C=C\C)=C(C)C.CC.CCC
InChIInChI=1S/C19H28.C3H8.C2H6/c1-9-11-16(7)17(8)19(13-14(3)4)18(12-10-2)15(5)6;1-3-2;1-2/h9-13H,7H2,1-6,8H3;3H2,1-2H3;1-2H3/b11-9-,12-10-,19-17-;;
InChIKeyUPMDNPOFOUVTAF-IIZTZMOZSA-N
XLogP8.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.60
LogP ≤ 58.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(4Z)-2-methyl-3-propan-2-ylidenehexa-1,4-diene
CID 142293143
5-methyl-3-propan-2-ylidenehexa-1,4-dien-2-amine
CID 126636597
2,5-dimethyl-4-propan-2-ylidenehepta-2,5-diene
CID 123312378
but-2-ene;2-methylbut-1-ene
CID 160732246
(E)-but-2-ene;2-methylbut-1-ene
CID 160732245
ethane;(3Z)-2-methylpenta-1,3-diene
CID 142023424
ethane;(3E)-2-methylpenta-1,3-diene
CID 143682849
(3Z)-2,5-dimethylhexa-1,3,5-triene;ethane;propane
CID 144971150
5-bromo-4-ethyl-6-methylidenenona-2,4,7-triene
CID 123219391
(5Z)-3,4-dimethylidenehepta-1,5-diene;ethane
CID 143166172
(5Z)-3,4-dimethylidenehepta-1,5-diene;ethane
CID 145140668
6-propan-2-ylidene-5-prop-1-en-2-ylnona-2,4,7-triene
CID 123924693

Frequently Asked Questions

What is the IUPAC name of ethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane?
The IUPAC name of ethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane (CID 144537696) is ethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane.
What is the SMILES notation for ethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane?
The canonical SMILES for ethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane is C=C(/C=C\C)C(C)=C(C=C(C)C)C(/C=C\C)=C(C)C.CC.CCC.
What is the InChIKey of ethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane?
The InChIKey is UPMDNPOFOUVTAF-IIZTZMOZSA-N. The full InChI is InChI=1S/C19H28.C3H8.C2H6/c1-9-11-16(7)17(8)19(13-14(3)4)18(12-10-2)15(5)6;1-3-2;1-2/h9-13H,7H2,1-6,8H3;3H2,1-2H3;1-2H3/b11-9-,12-10-,19-17-;;.
What are the key properties of ethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane?
ethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane has a molecular weight of 330.60 g/mol, XLogP of 8.76, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(2Z,5Z,8Z)-5-methyl-4-methylidene-6-(2-methylprop-1-enyl)-7-propan-2-ylidenedeca-2,5,8-triene;propane is sourced from PubChem (CID 144537696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).