(5Z)-2,8,9-trimethyldeca-1,5-diene

C13H24 — CID 142222870

IUPAC(5Z)-2,8,9-trimethyldeca-1,5-diene
SMILESC=C(C)CC/C=C\CC(C)C(C)C
InChIInChI=1S/C13H24/c1-11(2)9-7-6-8-10-13(5)12(3)4/h6,8,12-13H,1,7,9-10H2,2-5H3/b8-6-
InChIKeyCQLPHXJYHANHAE-VURMDHGXSA-N
MW180.33 g/mol
LogP4.58
Rot. Bonds6

About (5Z)-2,8,9-trimethyldeca-1,5-diene

(5Z)-2,8,9-trimethyldeca-1,5-diene (PubChem CID 142222870) has the molecular formula C13H24 and a molecular weight of 180.33 g/mol. Its IUPAC name is (5Z)-2,8,9-trimethyldeca-1,5-diene.

Molecular Properties

Compound Name(5Z)-2,8,9-trimethyldeca-1,5-diene
PubChem CID142222870
Molecular FormulaC13H24
Molecular Weight180.33 g/mol
Exact Mass180.19
IUPAC Name(5Z)-2,8,9-trimethyldeca-1,5-diene
SMILESC=C(C)CC/C=C\CC(C)C(C)C
InChIInChI=1S/C13H24/c1-11(2)9-7-6-8-10-13(5)12(3)4/h6,8,12-13H,1,7,9-10H2,2-5H3/b8-6-
InChIKeyCQLPHXJYHANHAE-VURMDHGXSA-N
XLogP4.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
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': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2,6,7-trimethylocta-1,3-diene
CID 123885530
(2E)-6-methylhepta-2,6-dien-1-ol
CID 11105375
(2Z)-6-methylhepta-2,6-dien-1-ol
CID 11217260
2-methyldeca-1,5,9-triene
CID 163214311
ethane;(5E)-2-methylhepta-1,5-diene
CID 143084582
6-methylhepta-2,6-dienal
CID 54465037
(3E)-7-methyl-N-propylocta-3,7-dien-1-amine
CID 114477529
10-methylundeca-6,10-dienoic acid
CID 163214310
(3Z)-6,7-dimethylocta-1,3-diene
CID 145174537
2,3-dimethyldec-5-ene;3,4-dimethyldec-5-ene
CID 173464801
5-ethyl-2-methyldeca-1,7-diene
CID 123598746
(4E)-4,8-dimethylnona-4,8-dien-3-one
CID 20501743

Frequently Asked Questions

What is the IUPAC name of (5Z)-2,8,9-trimethyldeca-1,5-diene?
The IUPAC name of (5Z)-2,8,9-trimethyldeca-1,5-diene (CID 142222870) is (5Z)-2,8,9-trimethyldeca-1,5-diene.
What is the SMILES notation for (5Z)-2,8,9-trimethyldeca-1,5-diene?
The canonical SMILES for (5Z)-2,8,9-trimethyldeca-1,5-diene is C=C(C)CC/C=C\CC(C)C(C)C.
What is the InChIKey of (5Z)-2,8,9-trimethyldeca-1,5-diene?
The InChIKey is CQLPHXJYHANHAE-VURMDHGXSA-N. The full InChI is InChI=1S/C13H24/c1-11(2)9-7-6-8-10-13(5)12(3)4/h6,8,12-13H,1,7,9-10H2,2-5H3/b8-6-.
What are the key properties of (5Z)-2,8,9-trimethyldeca-1,5-diene?
(5Z)-2,8,9-trimethyldeca-1,5-diene has a molecular weight of 180.33 g/mol, XLogP of 4.58, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-2,8,9-trimethyldeca-1,5-diene is sourced from PubChem (CID 142222870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).