(1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene

C14H22 — CID 21160273

IUPAC(1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene
SMILESC=C1CC/C=C\CC/C=C\CC1(C)C
InChIInChI=1S/C14H22/c1-13-11-9-7-5-4-6-8-10-12-14(13,2)3/h5,7-8,10H,1,4,6,9,11-12H2,2-3H3/b7-5-,10-8-
InChIKeyJGOFSHMHNOXTRH-RRMOSLQNSA-N
MW190.33 g/mol
LogP4.65
Rot. Bonds

About (1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene

(1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene (PubChem CID 21160273) has the molecular formula C14H22 and a molecular weight of 190.33 g/mol. Its IUPAC name is (1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene.

Molecular Properties

Compound Name(1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene
PubChem CID21160273
Molecular FormulaC14H22
Molecular Weight190.33 g/mol
Exact Mass190.17
IUPAC Name(1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene
SMILESC=C1CC/C=C\CC/C=C\CC1(C)C
InChIInChI=1S/C14H22/c1-13-11-9-7-5-4-6-8-10-12-14(13,2)3/h5,7-8,10H,1,4,6,9,11-12H2,2-3H3/b7-5-,10-8-
InChIKeyJGOFSHMHNOXTRH-RRMOSLQNSA-N
XLogP4.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.33
LogP ≤ 54.65
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 (1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene?
The IUPAC name of (1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene (CID 21160273) is (1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene.
What is the SMILES notation for (1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene?
The canonical SMILES for (1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene is C=C1CC/C=C\CC/C=C\CC1(C)C.
What is the InChIKey of (1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene?
The InChIKey is JGOFSHMHNOXTRH-RRMOSLQNSA-N. The full InChI is InChI=1S/C14H22/c1-13-11-9-7-5-4-6-8-10-12-14(13,2)3/h5,7-8,10H,1,4,6,9,11-12H2,2-3H3/b7-5-,10-8-.
What are the key properties of (1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene?
(1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene has a molecular weight of 190.33 g/mol, XLogP of 4.65, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,5Z)-8,8-dimethyl-9-methylidenecycloundeca-1,5-diene is sourced from PubChem (CID 21160273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).