(3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene

C13H24 — CID 143683462

IUPAC(3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene
SMILESCC/C=C\C=C(\CC)C(C)C(C)C
InChIInChI=1S/C13H24/c1-6-8-9-10-13(7-2)12(5)11(3)4/h8-12H,6-7H2,1-5H3/b9-8-,13-10-
InChIKeyNOESPVOVJDKKME-AGMBNHQJSA-N
MW180.33 g/mol
LogP4.58
Rot. Bonds5

About (3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene

(3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene (PubChem CID 143683462) has the molecular formula C13H24 and a molecular weight of 180.33 g/mol. Its IUPAC name is (3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene.

Molecular Properties

Compound Name(3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene
PubChem CID143683462
Molecular FormulaC13H24
Molecular Weight180.33 g/mol
Exact Mass180.19
IUPAC Name(3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene
SMILESCC/C=C\C=C(\CC)C(C)C(C)C
InChIInChI=1S/C13H24/c1-6-8-9-10-13(7-2)12(5)11(3)4/h8-12H,6-7H2,1-5H3/b9-8-,13-10-
InChIKeyNOESPVOVJDKKME-AGMBNHQJSA-N
XLogP4.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.33
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(3E,5Z)-3-ethyl-2-fluoroocta-3,5-dienenitrile
CID 126595988
(5E)-octa-3,5-diene
CID 173104147
ethane;(2E,4Z)-hepta-2,4-dien-2-ol
CID 142115176
4-methylnona-4,6-dien-3-ol
CID 90740001
(2E,4Z)-1-amino-2-methylhepta-2,4-dien-1-ol
CID 163982381
octa-3,5-dien-2-ol
CID 543636
(2E,4E)-2-methylhepta-2,4-dien-1-ol
CID 173250100
ethane;(3Z,5Z)-octa-3,5-diene
CID 142104932
(2E,4Z)-2-methylhepta-2,4-diene-1-thiol
CID 145391343
(2Z,4Z)-N-methylhepta-2,4-dien-2-amine
CID 89431682
hex-3-ene;sulfane
CID 174453265
hex-3-ene;hydrochloride
CID 159012047

Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene?
The IUPAC name of (3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene (CID 143683462) is (3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene.
What is the SMILES notation for (3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene?
The canonical SMILES for (3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene is CC/C=C\C=C(\CC)C(C)C(C)C.
What is the InChIKey of (3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene?
The InChIKey is NOESPVOVJDKKME-AGMBNHQJSA-N. The full InChI is InChI=1S/C13H24/c1-6-8-9-10-13(7-2)12(5)11(3)4/h8-12H,6-7H2,1-5H3/b9-8-,13-10-.
What are the key properties of (3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene?
(3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene has a molecular weight of 180.33 g/mol, XLogP of 4.58, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-6-ethyl-7,8-dimethylnona-3,5-diene is sourced from PubChem (CID 143683462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).