(3Z,7E)-4-ethenylnona-1,3,7-triene

C11H16 — CID 144915072

IUPAC(3Z,7E)-4-ethenylnona-1,3,7-triene
SMILESC=C/C=C(\C=C)CC/C=C/C
InChIInChI=1S/C11H16/c1-4-7-8-10-11(6-3)9-5-2/h4-7,9H,2-3,8,10H2,1H3/b7-4+,11-9+
InChIKeyIKYLZLUHFWASQY-WUZDHUPESA-N
MW148.25 g/mol
LogP3.64
Rot. Bonds5

About (3Z,7E)-4-ethenylnona-1,3,7-triene

(3Z,7E)-4-ethenylnona-1,3,7-triene (PubChem CID 144915072) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is (3Z,7E)-4-ethenylnona-1,3,7-triene.

Molecular Properties

Compound Name(3Z,7E)-4-ethenylnona-1,3,7-triene
PubChem CID144915072
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Name(3Z,7E)-4-ethenylnona-1,3,7-triene
SMILESC=C/C=C(\C=C)CC/C=C/C
InChIInChI=1S/C11H16/c1-4-7-8-10-11(6-3)9-5-2/h4-7,9H,2-3,8,10H2,1H3/b7-4+,11-9+
InChIKeyIKYLZLUHFWASQY-WUZDHUPESA-N
XLogP3.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3Z,7E)-4-ethenylnona-1,3,7-triene?
The IUPAC name of (3Z,7E)-4-ethenylnona-1,3,7-triene (CID 144915072) is (3Z,7E)-4-ethenylnona-1,3,7-triene.
What is the SMILES notation for (3Z,7E)-4-ethenylnona-1,3,7-triene?
The canonical SMILES for (3Z,7E)-4-ethenylnona-1,3,7-triene is C=C/C=C(\C=C)CC/C=C/C.
What is the InChIKey of (3Z,7E)-4-ethenylnona-1,3,7-triene?
The InChIKey is IKYLZLUHFWASQY-WUZDHUPESA-N. The full InChI is InChI=1S/C11H16/c1-4-7-8-10-11(6-3)9-5-2/h4-7,9H,2-3,8,10H2,1H3/b7-4+,11-9+.
What are the key properties of (3Z,7E)-4-ethenylnona-1,3,7-triene?
(3Z,7E)-4-ethenylnona-1,3,7-triene has a molecular weight of 148.25 g/mol, XLogP of 3.64, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,7E)-4-ethenylnona-1,3,7-triene is sourced from PubChem (CID 144915072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).