(2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol

C11H20O — CID 101448778

IUPAC(2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol
SMILESCCC(C)/C=C(C)\C=C(/C)CO
InChIInChI=1S/C11H20O/c1-5-9(2)6-10(3)7-11(4)8-12/h6-7,9,12H,5,8H2,1-4H3/b10-6-,11-7+
InChIKeyTVFZGOGNJSRZGO-NAKBGQTNSA-N
MW168.28 g/mol
LogP2.92
Rot. Bonds4

About (2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol

(2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol (PubChem CID 101448778) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is (2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol.

Molecular Properties

Compound Name(2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol
PubChem CID101448778
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name(2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol
SMILESCCC(C)/C=C(C)\C=C(/C)CO
InChIInChI=1S/C11H20O/c1-5-9(2)6-10(3)7-11(4)8-12/h6-7,9,12H,5,8H2,1-4H3/b10-6-,11-7+
InChIKeyTVFZGOGNJSRZGO-NAKBGQTNSA-N
XLogP2.92
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E,5S)-3,5-dimethylhept-3-ene
CID 25021557
(4R)-2,4-dimethylhex-2-ene
CID 142611901
2,4-dimethylpent-2-en-1-ol
CID 54511819
(E)-4-methyl-N-propan-2-ylhex-2-en-2-amine
CID 166949903
4,6-dimethyloct-4-enal
CID 71411187
(E)-2,5-dimethylhept-2-en-1-ol
CID 88722720
(2E,4E,6E,8E)-8,10-dimethyldodeca-2,4,6,8-tetraenoic acid;methanesulfonic acid
CID 72707212
(E)-2,4-dimethyl-N-propylhex-2-en-1-amine
CID 79340919
N-[(E)-4-methylhex-2-en-2-yl]ethanimine
CID 90864591
(Z)-5-methoxy-2,4-dimethylpent-2-en-1-ol
CID 116503510
(E,4S)-2-methyl-4-(methylamino)hex-2-en-1-ol
CID 143024132
6-iodo-2,4-dimethylhept-2-en-1-ol
CID 54317872

Frequently Asked Questions

What is the IUPAC name of (2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol?
The IUPAC name of (2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol (CID 101448778) is (2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol.
What is the SMILES notation for (2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol?
The canonical SMILES for (2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol is CCC(C)/C=C(C)\C=C(/C)CO.
What is the InChIKey of (2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol?
The InChIKey is TVFZGOGNJSRZGO-NAKBGQTNSA-N. The full InChI is InChI=1S/C11H20O/c1-5-9(2)6-10(3)7-11(4)8-12/h6-7,9,12H,5,8H2,1-4H3/b10-6-,11-7+.
What are the key properties of (2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol?
(2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol has a molecular weight of 168.28 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4Z)-2,4,6-trimethylocta-2,4-dien-1-ol is sourced from PubChem (CID 101448778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).