(3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene

C18H24 — CID 177318715

IUPAC(3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene
SMILESC=C/C=C\C(C(=C)C/C(C=C)=C/C=C\C)=C(C)C
InChIInChI=1S/C18H24/c1-7-10-12-17(9-3)14-16(6)18(15(4)5)13-11-8-2/h7-13H,2-3,6,14H2,1,4-5H3/b10-7-,13-11-,17-12+
InChIKeyKAILUAIKXPTFJJ-TWONWCFGSA-N
MW240.39 g/mol
LogP5.70
Rot. Bonds7

About (3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene

(3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene (PubChem CID 177318715) has the molecular formula C18H24 and a molecular weight of 240.39 g/mol. Its IUPAC name is (3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene.

Molecular Properties

Compound Name(3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene
PubChem CID177318715
Molecular FormulaC18H24
Molecular Weight240.39 g/mol
Exact Mass240.19
IUPAC Name(3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene
SMILESC=C/C=C\C(C(=C)C/C(C=C)=C/C=C\C)=C(C)C
InChIInChI=1S/C18H24/c1-7-10-12-17(9-3)14-16(6)18(15(4)5)13-11-8-2/h7-13H,2-3,6,14H2,1,4-5H3/b10-7-,13-11-,17-12+
InChIKeyKAILUAIKXPTFJJ-TWONWCFGSA-N
XLogP5.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.39
LogP ≤ 55.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene?
The IUPAC name of (3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene (CID 177318715) is (3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene.
What is the SMILES notation for (3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene?
The canonical SMILES for (3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene is C=C/C=C\C(C(=C)C/C(C=C)=C/C=C\C)=C(C)C.
What is the InChIKey of (3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene?
The InChIKey is KAILUAIKXPTFJJ-TWONWCFGSA-N. The full InChI is InChI=1S/C18H24/c1-7-10-12-17(9-3)14-16(6)18(15(4)5)13-11-8-2/h7-13H,2-3,6,14H2,1,4-5H3/b10-7-,13-11-,17-12+.
What are the key properties of (3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene?
(3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene has a molecular weight of 240.39 g/mol, XLogP of 5.70, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,8Z,10Z)-8-ethenyl-6-methylidene-5-propan-2-ylidenedodeca-1,3,8,10-tetraene is sourced from PubChem (CID 177318715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).