(1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene

C20H28 — CID 5374959

IUPAC(1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene
SMILESCC(C)=C1/C=C\C(=C(C)C)C(=C(C)C)/C=C\C1=C(C)C
InChIInChI=1S/C20H28/c1-13(2)17-9-10-19(15(5)6)20(16(7)8)12-11-18(17)14(3)4/h9-12H,1-8H3/b10-9-,12-11-
InChIKeyOGWQYKWKVGIBSR-BASFJDSNSA-N
MW268.44 g/mol
LogP6.46
Rot. Bonds

About (1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene

(1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene (PubChem CID 5374959) has the molecular formula C20H28 and a molecular weight of 268.44 g/mol. Its IUPAC name is (1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene.

Molecular Properties

Compound Name(1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene
PubChem CID5374959
Molecular FormulaC20H28
Molecular Weight268.44 g/mol
Exact Mass268.22
IUPAC Name(1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene
SMILESCC(C)=C1/C=C\C(=C(C)C)C(=C(C)C)/C=C\C1=C(C)C
InChIInChI=1S/C20H28/c1-13(2)17-9-10-19(15(5)6)20(16(7)8)12-11-18(17)14(3)4/h9-12H,1-8H3/b10-9-,12-11-
InChIKeyOGWQYKWKVGIBSR-BASFJDSNSA-N
XLogP6.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.44
LogP ≤ 56.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

trans-Alloocimene
CID 5368821
Farnesene
CID 5281516
beta-Ocimene
CID 18756
beta-Ocimene, (3Z)-
CID 5320250
beta-OCIMENE, (3E)-
CID 5281553
2,6-Dimethylocta-2,4,6-triene
CID 12658
(Z,E)-alpha-Farnesene
CID 5362889
(3E)-4,8-dimethyl-1,3,7-nonatriene
CID 6427110
(E,E)-4,8,12-Trimethyl-1,3,7,11-tridecatetraene
CID 6443227
alpha-Ocimene
CID 5320249
(4E,6E,8E,10E,12E,14E,16E,18E)-2,6,10,15,19,23-Hexamethyl-2,4,6,8,10,12,14,16,18,22-tetracosadecaene
CID 6443791
15-cis-4,4'-Diapophytoene
CID 14019219

Frequently Asked Questions

What is the IUPAC name of (1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene?
The IUPAC name of (1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene (CID 5374959) is (1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene.
What is the SMILES notation for (1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene?
The canonical SMILES for (1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene is CC(C)=C1/C=C\C(=C(C)C)C(=C(C)C)/C=C\C1=C(C)C.
What is the InChIKey of (1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene?
The InChIKey is OGWQYKWKVGIBSR-BASFJDSNSA-N. The full InChI is InChI=1S/C20H28/c1-13(2)17-9-10-19(15(5)6)20(16(7)8)12-11-18(17)14(3)4/h9-12H,1-8H3/b10-9-,12-11-.
What are the key properties of (1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene?
(1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene has a molecular weight of 268.44 g/mol, XLogP of 6.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,5Z)-3,4,7,8-tetra(propan-2-ylidene)cycloocta-1,5-diene is sourced from PubChem (CID 5374959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).