1-[1-(methoxymethoxy)ethyl]cyclohexene

C10H18O2 — CID 542494

IUPAC1-[1-(methoxymethoxy)ethyl]cyclohexene
SMILESCOCOC(C)C1=CCCCC1
InChIInChI=1S/C10H18O2/c1-9(12-8-11-2)10-6-4-3-5-7-10/h6,9H,3-5,7-8H2,1-2H3
InChIKeyUBDPEQSGZGNQSQ-UHFFFAOYSA-N
MW170.25 g/mol
LogP2.50
Rot. Bonds4

About 1-[1-(methoxymethoxy)ethyl]cyclohexene

1-[1-(methoxymethoxy)ethyl]cyclohexene (PubChem CID 542494) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 1-[1-(methoxymethoxy)ethyl]cyclohexene.

Molecular Properties

Compound Name1-[1-(methoxymethoxy)ethyl]cyclohexene
PubChem CID542494
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name1-[1-(methoxymethoxy)ethyl]cyclohexene
SMILESCOCOC(C)C1=CCCCC1
InChIInChI=1S/C10H18O2/c1-9(12-8-11-2)10-6-4-3-5-7-10/h6,9H,3-5,7-8H2,1-2H3
InChIKeyUBDPEQSGZGNQSQ-UHFFFAOYSA-N
XLogP2.50
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 52.50
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

1-Undecene, 11,11-bis[(3,7-dimethyl-2,6-octadien-1-yl)oxy]-
CID 6437125
1-Undecene, 11,11-bis(3,7-dimethyl-2,6-octadienyl)oxy-
CID 105593
[(2Z)-cyclooct-2-en-1-yl] methyl carbonate
CID 15550934
(2-Ethylcyclohexen-1-yl) prop-2-enyl carbonate
CID 45094946
1,1-Bis[(3,7-dimethyl-2,6-octadien-1-yl)oxy]nonane
CID 105592
Nonane, 1,1-bis[(3,7-dimethyl-2,6-octadien-1-yl)oxy]-
CID 6437124
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
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
(E,4S)-4-(methoxymethoxy)tridec-2-en-1-ol
CID 56650372

Frequently Asked Questions

What is the IUPAC name of 1-[1-(methoxymethoxy)ethyl]cyclohexene?
The IUPAC name of 1-[1-(methoxymethoxy)ethyl]cyclohexene (CID 542494) is 1-[1-(methoxymethoxy)ethyl]cyclohexene.
What is the SMILES notation for 1-[1-(methoxymethoxy)ethyl]cyclohexene?
The canonical SMILES for 1-[1-(methoxymethoxy)ethyl]cyclohexene is COCOC(C)C1=CCCCC1.
What is the InChIKey of 1-[1-(methoxymethoxy)ethyl]cyclohexene?
The InChIKey is UBDPEQSGZGNQSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-9(12-8-11-2)10-6-4-3-5-7-10/h6,9H,3-5,7-8H2,1-2H3.
What are the key properties of 1-[1-(methoxymethoxy)ethyl]cyclohexene?
1-[1-(methoxymethoxy)ethyl]cyclohexene has a molecular weight of 170.25 g/mol, XLogP of 2.50, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(methoxymethoxy)ethyl]cyclohexene is sourced from PubChem (CID 542494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).