(6Z)-4,4-bis(methoxymethyl)nona-1,6-diene

C13H24O2 — CID 101031970

IUPAC(6Z)-4,4-bis(methoxymethyl)nona-1,6-diene
SMILESC=CCC(C/C=C\CC)(COC)COC
InChIInChI=1S/C13H24O2/c1-5-7-8-10-13(9-6-2,11-14-3)12-15-4/h6-8H,2,5,9-12H2,1,3-4H3/b8-7-
InChIKeyDCLHRGIQWAWEKD-FPLPWBNLSA-N
MW212.33 g/mol
LogP3.20
Rot. Bonds9

About (6Z)-4,4-bis(methoxymethyl)nona-1,6-diene

(6Z)-4,4-bis(methoxymethyl)nona-1,6-diene (PubChem CID 101031970) has the molecular formula C13H24O2 and a molecular weight of 212.33 g/mol. Its IUPAC name is (6Z)-4,4-bis(methoxymethyl)nona-1,6-diene.

Molecular Properties

Compound Name(6Z)-4,4-bis(methoxymethyl)nona-1,6-diene
PubChem CID101031970
Molecular FormulaC13H24O2
Molecular Weight212.33 g/mol
Exact Mass212.18
IUPAC Name(6Z)-4,4-bis(methoxymethyl)nona-1,6-diene
SMILESC=CCC(C/C=C\CC)(COC)COC
InChIInChI=1S/C13H24O2/c1-5-7-8-10-13(9-6-2,11-14-3)12-15-4/h6-8H,2,5,9-12H2,1,3-4H3/b8-7-
InChIKeyDCLHRGIQWAWEKD-FPLPWBNLSA-N
XLogP3.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.33
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(1-(Methoxymethyl)cyclopent-3-en-1-yl)methanol
CID 53753373
4,4-Bis(methoxymethyl)-1,6-heptadiene
CID 11074076
4,4-Bis(vinyloxymethyl)cyclohexene
CID 89106982
4,4-Bis(ethoxymethyl)-1,6-heptadiene
CID 102449668
4,4-Bis(methoxymethyl)-5-methylhex-1-ene
CID 138966360
(2E,7E)-5,5-bis(prop-2-enoxymethyl)nona-2,7-diene
CID 101200823
4,4-Bis(methoxymethyl)oct-1-en-6-yne
CID 101229212
(5E)-8,8-bis(methoxymethyl)undeca-5,10-dien-2-one
CID 102155837
4,4,9,9-Tetrakis(methoxymethyl)-1,6,11-dodecatriene
CID 129851483
4,4,9,9-Tetrakis(ethoxymethyl)-1,6,11-dodecatriene
CID 129851492
2-Allyl-2-(3-methylbut-2-en-1-yl)propane-1,3-diol
CID 129891929
(1E,6E)-1,7-dimethoxy-4,4-dimethylocta-1,6-diene
CID 10442729

Frequently Asked Questions

What is the IUPAC name of (6Z)-4,4-bis(methoxymethyl)nona-1,6-diene?
The IUPAC name of (6Z)-4,4-bis(methoxymethyl)nona-1,6-diene (CID 101031970) is (6Z)-4,4-bis(methoxymethyl)nona-1,6-diene.
What is the SMILES notation for (6Z)-4,4-bis(methoxymethyl)nona-1,6-diene?
The canonical SMILES for (6Z)-4,4-bis(methoxymethyl)nona-1,6-diene is C=CCC(C/C=C\CC)(COC)COC.
What is the InChIKey of (6Z)-4,4-bis(methoxymethyl)nona-1,6-diene?
The InChIKey is DCLHRGIQWAWEKD-FPLPWBNLSA-N. The full InChI is InChI=1S/C13H24O2/c1-5-7-8-10-13(9-6-2,11-14-3)12-15-4/h6-8H,2,5,9-12H2,1,3-4H3/b8-7-.
What are the key properties of (6Z)-4,4-bis(methoxymethyl)nona-1,6-diene?
(6Z)-4,4-bis(methoxymethyl)nona-1,6-diene has a molecular weight of 212.33 g/mol, XLogP of 3.20, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-4,4-bis(methoxymethyl)nona-1,6-diene is sourced from PubChem (CID 101031970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).