3-(methoxymethoxy)-1-methylcyclohexene

C9H16O2 — CID 542464

IUPAC3-(methoxymethoxy)-1-methylcyclohexene
SMILESCOCOC1C=C(C)CCC1
InChIInChI=1S/C9H16O2/c1-8-4-3-5-9(6-8)11-7-10-2/h6,9H,3-5,7H2,1-2H3
InChIKeyGIJNPHUCNMFTKV-UHFFFAOYSA-N
MW156.22 g/mol
LogP2.11
Rot. Bonds3

About 3-(methoxymethoxy)-1-methylcyclohexene

3-(methoxymethoxy)-1-methylcyclohexene (PubChem CID 542464) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 3-(methoxymethoxy)-1-methylcyclohexene.

Molecular Properties

Compound Name3-(methoxymethoxy)-1-methylcyclohexene
PubChem CID542464
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name3-(methoxymethoxy)-1-methylcyclohexene
SMILESCOCOC1C=C(C)CCC1
InChIInChI=1S/C9H16O2/c1-8-4-3-5-9(6-8)11-7-10-2/h6,9H,3-5,7H2,1-2H3
InChIKeyGIJNPHUCNMFTKV-UHFFFAOYSA-N
XLogP2.11
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

7-Methyl-1,4-dioxaspiro[4.5]dec-6-ene
CID 11137430
1-(Methoxymethoxy)-2-methylidenecyclohexane
CID 85819555
4,8-Dioxaspiro[2.5]oct-1-ene, 1-butyl-6,6-dimethyl-
CID 10420216
Methyl (2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-yl) carbonate
CID 11106628
6-methoxy-2-pentyl-3,6-dihydro-2H-pyran
CID 12462321
(E)-8-(methoxymethoxy)tridec-6-ene
CID 13267433
3-(2-Bromo-1-ethoxyethoxy)-1-methylcyclohex-1-ene
CID 13616444
(3E)-5-ethoxy-2-ethyl-3-heptylideneoxolane
CID 13973915
4-methyl-6-octyl-4H-1,3-dioxine
CID 14017438
(2S,4R)-4-(methoxymethoxy)-6-methyl-2-propyl-3,4-dihydro-2H-pyran
CID 25192102
Methyl 2-methyloct-2-en-4-yl carbonate
CID 85781669
5-(Ethoxymethoxy)-1-prop-2-enylcyclopentene
CID 86034407

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethoxy)-1-methylcyclohexene?
The IUPAC name of 3-(methoxymethoxy)-1-methylcyclohexene (CID 542464) is 3-(methoxymethoxy)-1-methylcyclohexene.
What is the SMILES notation for 3-(methoxymethoxy)-1-methylcyclohexene?
The canonical SMILES for 3-(methoxymethoxy)-1-methylcyclohexene is COCOC1C=C(C)CCC1.
What is the InChIKey of 3-(methoxymethoxy)-1-methylcyclohexene?
The InChIKey is GIJNPHUCNMFTKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-8-4-3-5-9(6-8)11-7-10-2/h6,9H,3-5,7H2,1-2H3.
What are the key properties of 3-(methoxymethoxy)-1-methylcyclohexene?
3-(methoxymethoxy)-1-methylcyclohexene has a molecular weight of 156.22 g/mol, XLogP of 2.11, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethoxy)-1-methylcyclohexene is sourced from PubChem (CID 542464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).