(1Z,3E,5Z)-cyclonona-1,3,5-triene

C9H12 — CID 12652504

IUPAC(1Z,3E,5Z)-cyclonona-1,3,5-triene
SMILESC1=C\CCC/C=C/C=C/1
InChIInChI=1S/C9H12/c1-2-4-6-8-9-7-5-3-1/h1-6H,7-9H2/b2-1+,5-3-,6-4-
InChIKeyFHBJNBBNAAXQKT-IVHLZNQZSA-N
MW120.19 g/mol
LogP2.84
Rot. Bonds

About (1Z,3E,5Z)-cyclonona-1,3,5-triene

(1Z,3E,5Z)-cyclonona-1,3,5-triene (PubChem CID 12652504) has the molecular formula C9H12 and a molecular weight of 120.19 g/mol. Its IUPAC name is (1Z,3E,5Z)-cyclonona-1,3,5-triene.

Molecular Properties

Compound Name(1Z,3E,5Z)-cyclonona-1,3,5-triene
PubChem CID12652504
Molecular FormulaC9H12
Molecular Weight120.19 g/mol
Exact Mass120.09
IUPAC Name(1Z,3E,5Z)-cyclonona-1,3,5-triene
SMILESC1=C\CCC/C=C/C=C/1
InChIInChI=1S/C9H12/c1-2-4-6-8-9-7-5-3-1/h1-6H,7-9H2/b2-1+,5-3-,6-4-
InChIKeyFHBJNBBNAAXQKT-IVHLZNQZSA-N
XLogP2.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.19
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(1Z,3Z,5Z,7Z,9Z,11Z,13Z,15Z,17Z,19Z)-cyclopentacosa-1,3,5,7,9,11,13,15,17,19,21-undecaene
CID 173020880
(1Z,3E,5E,7Z,9E)-cyclotrideca-1,3,5,7,9-pentaene
CID 143640992
(1E,3Z,8E,10Z)-cyclotetradeca-1,3,8,10-tetraene
CID 173030963
(1Z,3Z,5Z,7Z,9Z,11Z)-cyclohexadeca-1,3,5,7,9,11-hexaene
CID 172907233
(3Z,5Z,7Z,9E,11E,13E,15Z,17E,19E,21E,23Z)-cyclooctacosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaene
CID 173020706
(1Z,3E,5E,7Z,9E)-cyclotetradeca-1,3,5,7,9-pentaene
CID 173043953
cyclohepta-1,3-diene;cyclohexa-1,3-diene
CID 143080725
cyclotriaconta-1,3,5,7,9,11,13,15,17,19,21,23,25-tridecaene
CID 91803237
(3Z,5E,7E,9E,11Z,13E)-cyclodocosa-1,3,5,7,9,11,13-heptaene
CID 173020863
(1Z,3Z)-cyclopentacosa-1,3,5-triene
CID 173020832
(1Z,3Z)-cyclononadeca-1,3,5-triene
CID 173020691
(1E,7E)-cycloundeca-1,3,7-triene
CID 173030664

Frequently Asked Questions

What is the IUPAC name of (1Z,3E,5Z)-cyclonona-1,3,5-triene?
The IUPAC name of (1Z,3E,5Z)-cyclonona-1,3,5-triene (CID 12652504) is (1Z,3E,5Z)-cyclonona-1,3,5-triene.
What is the SMILES notation for (1Z,3E,5Z)-cyclonona-1,3,5-triene?
The canonical SMILES for (1Z,3E,5Z)-cyclonona-1,3,5-triene is C1=C\CCC/C=C/C=C/1.
What is the InChIKey of (1Z,3E,5Z)-cyclonona-1,3,5-triene?
The InChIKey is FHBJNBBNAAXQKT-IVHLZNQZSA-N. The full InChI is InChI=1S/C9H12/c1-2-4-6-8-9-7-5-3-1/h1-6H,7-9H2/b2-1+,5-3-,6-4-.
What are the key properties of (1Z,3E,5Z)-cyclonona-1,3,5-triene?
(1Z,3E,5Z)-cyclonona-1,3,5-triene has a molecular weight of 120.19 g/mol, XLogP of 2.84, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3E,5Z)-cyclonona-1,3,5-triene is sourced from PubChem (CID 12652504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).