(7Z)-cyclohexadeca-1,7-diene

C16H28 — CID 173129118

IUPAC(7Z)-cyclohexadeca-1,7-diene
SMILESC1=CCCCCCCCC/C=C\CCCC1
InChIInChI=1S/C16H28/c1-2-4-6-8-10-12-14-16-15-13-11-9-7-5-3-1/h1-2,11,13H,3-10,12,14-16H2/b2-1-,13-11?
InChIKeyIIWRTNHGXDXSJU-NZBQCFNASA-N
MW220.40 g/mol
LogP5.79
Rot. Bonds

About (7Z)-cyclohexadeca-1,7-diene

(7Z)-cyclohexadeca-1,7-diene (PubChem CID 173129118) has the molecular formula C16H28 and a molecular weight of 220.40 g/mol. Its IUPAC name is (7Z)-cyclohexadeca-1,7-diene.

Molecular Properties

Compound Name(7Z)-cyclohexadeca-1,7-diene
PubChem CID173129118
Molecular FormulaC16H28
Molecular Weight220.40 g/mol
Exact Mass220.22
IUPAC Name(7Z)-cyclohexadeca-1,7-diene
SMILESC1=CCCCCCCCC/C=C\CCCC1
InChIInChI=1S/C16H28/c1-2-4-6-8-10-12-14-16-15-13-11-9-7-5-3-1/h1-2,11,13H,3-10,12,14-16H2/b2-1-,13-11?
InChIKeyIIWRTNHGXDXSJU-NZBQCFNASA-N
XLogP5.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500220.40
LogP ≤ 55.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (7Z)-cyclohexadeca-1,7-diene?
The IUPAC name of (7Z)-cyclohexadeca-1,7-diene (CID 173129118) is (7Z)-cyclohexadeca-1,7-diene.
What is the SMILES notation for (7Z)-cyclohexadeca-1,7-diene?
The canonical SMILES for (7Z)-cyclohexadeca-1,7-diene is C1=CCCCCCCCC/C=C\CCCC1.
What is the InChIKey of (7Z)-cyclohexadeca-1,7-diene?
The InChIKey is IIWRTNHGXDXSJU-NZBQCFNASA-N. The full InChI is InChI=1S/C16H28/c1-2-4-6-8-10-12-14-16-15-13-11-9-7-5-3-1/h1-2,11,13H,3-10,12,14-16H2/b2-1-,13-11?.
What are the key properties of (7Z)-cyclohexadeca-1,7-diene?
(7Z)-cyclohexadeca-1,7-diene has a molecular weight of 220.40 g/mol, XLogP of 5.79, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (7Z)-cyclohexadeca-1,7-diene is sourced from PubChem (CID 173129118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).