(Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene

C16H26 — CID 156886763

IUPAC(Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene
SMILESC=C(C(CCCC)=C(C)C)C(/C=C\C)=C/C
InChIInChI=1S/C16H26/c1-7-10-12-16(13(4)5)14(6)15(9-3)11-8-2/h8-9,11H,6-7,10,12H2,1-5H3/b11-8-,15-9+
InChIKeyYQXZOKRQXGJKBA-QBDLBBPBSA-N
MW218.38 g/mol
LogP5.59
Rot. Bonds6

About (Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene

(Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene (PubChem CID 156886763) has the molecular formula C16H26 and a molecular weight of 218.38 g/mol. Its IUPAC name is (Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene.

Molecular Properties

Compound Name(Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene
PubChem CID156886763
Molecular FormulaC16H26
Molecular Weight218.38 g/mol
Exact Mass218.20
IUPAC Name(Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene
SMILESC=C(C(CCCC)=C(C)C)C(/C=C\C)=C/C
InChIInChI=1S/C16H26/c1-7-10-12-16(13(4)5)14(6)15(9-3)11-8-2/h8-9,11H,6-7,10,12H2,1-5H3/b11-8-,15-9+
InChIKeyYQXZOKRQXGJKBA-QBDLBBPBSA-N
XLogP5.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500218.38
LogP ≤ 55.59
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 (Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene?
The IUPAC name of (Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene (CID 156886763) is (Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene.
What is the SMILES notation for (Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene?
The canonical SMILES for (Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene is C=C(C(CCCC)=C(C)C)C(/C=C\C)=C/C.
What is the InChIKey of (Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene?
The InChIKey is YQXZOKRQXGJKBA-QBDLBBPBSA-N. The full InChI is InChI=1S/C16H26/c1-7-10-12-16(13(4)5)14(6)15(9-3)11-8-2/h8-9,11H,6-7,10,12H2,1-5H3/b11-8-,15-9+.
What are the key properties of (Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene?
(Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene has a molecular weight of 218.38 g/mol, XLogP of 5.59, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,4E)-4-ethylidene-5-methylidene-6-propan-2-ylidenedec-2-ene is sourced from PubChem (CID 156886763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).