(7Z)-9-ethyl-6-methylidenedodeca-1,7-diene

C15H26 — CID 155779414

IUPAC(7Z)-9-ethyl-6-methylidenedodeca-1,7-diene
SMILESC=CCCCC(=C)/C=C\C(CC)CCC
InChIInChI=1S/C15H26/c1-5-8-9-11-14(4)12-13-15(7-3)10-6-2/h5,12-13,15H,1,4,6-11H2,2-3H3/b13-12-
InChIKeyXJYVHANFMXBTGO-SEYXRHQNSA-N
MW206.37 g/mol
LogP5.28
Rot. Bonds9

About (7Z)-9-ethyl-6-methylidenedodeca-1,7-diene

(7Z)-9-ethyl-6-methylidenedodeca-1,7-diene (PubChem CID 155779414) has the molecular formula C15H26 and a molecular weight of 206.37 g/mol. Its IUPAC name is (7Z)-9-ethyl-6-methylidenedodeca-1,7-diene.

Molecular Properties

Compound Name(7Z)-9-ethyl-6-methylidenedodeca-1,7-diene
PubChem CID155779414
Molecular FormulaC15H26
Molecular Weight206.37 g/mol
Exact Mass206.20
IUPAC Name(7Z)-9-ethyl-6-methylidenedodeca-1,7-diene
SMILESC=CCCCC(=C)/C=C\C(CC)CCC
InChIInChI=1S/C15H26/c1-5-8-9-11-14(4)12-13-15(7-3)10-6-2/h5,12-13,15H,1,4,6-11H2,2-3H3/b13-12-
InChIKeyXJYVHANFMXBTGO-SEYXRHQNSA-N
XLogP5.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500206.37
LogP ≤ 55.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(6E)-6-ethylidenedec-1-ene
CID 173031906
2-propyldodec-11-enal
CID 142653916
4-ethylhept-2-ene
CID 54449444
(E)-11-methylidene-8-(4-methylpent-4-enyl)hexadec-9-en-1-amine
CID 142974138
(Z)-2-methyl-5-methylideneoct-3-ene
CID 143255945
7-methylidenedec-1-ene
CID 123417470
(5R,6S)-dec-1-ene-5,6-diol
CID 10511398
non-8-en-4-one
CID 11137251
(4S)-non-8-en-4-amine
CID 10678342
(5R,6R)-dec-1-ene-5,6-diol
CID 10844929
(4R)-non-8-en-4-amine
CID 10796847
9-propyldodec-1-ene
CID 174048054

Frequently Asked Questions

What is the IUPAC name of (7Z)-9-ethyl-6-methylidenedodeca-1,7-diene?
The IUPAC name of (7Z)-9-ethyl-6-methylidenedodeca-1,7-diene (CID 155779414) is (7Z)-9-ethyl-6-methylidenedodeca-1,7-diene.
What is the SMILES notation for (7Z)-9-ethyl-6-methylidenedodeca-1,7-diene?
The canonical SMILES for (7Z)-9-ethyl-6-methylidenedodeca-1,7-diene is C=CCCCC(=C)/C=C\C(CC)CCC.
What is the InChIKey of (7Z)-9-ethyl-6-methylidenedodeca-1,7-diene?
The InChIKey is XJYVHANFMXBTGO-SEYXRHQNSA-N. The full InChI is InChI=1S/C15H26/c1-5-8-9-11-14(4)12-13-15(7-3)10-6-2/h5,12-13,15H,1,4,6-11H2,2-3H3/b13-12-.
What are the key properties of (7Z)-9-ethyl-6-methylidenedodeca-1,7-diene?
(7Z)-9-ethyl-6-methylidenedodeca-1,7-diene has a molecular weight of 206.37 g/mol, XLogP of 5.28, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (7Z)-9-ethyl-6-methylidenedodeca-1,7-diene is sourced from PubChem (CID 155779414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).