(Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene

C11H22O4 — CID 134898164

IUPAC(Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene
SMILESCOCOC/C=C\C(OCOC)C(C)C
InChIInChI=1S/C11H22O4/c1-10(2)11(15-9-13-4)6-5-7-14-8-12-3/h5-6,10-11H,7-9H2,1-4H3/b6-5-
InChIKeyFDWYTDGKAUGPOA-WAYWQWQTSA-N
MW218.29 g/mol
LogP1.81
Rot. Bonds9

About (Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene

(Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene (PubChem CID 134898164) has the molecular formula C11H22O4 and a molecular weight of 218.29 g/mol. Its IUPAC name is (Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene.

Molecular Properties

Compound Name(Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene
PubChem CID134898164
Molecular FormulaC11H22O4
Molecular Weight218.29 g/mol
Exact Mass218.15
IUPAC Name(Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene
SMILESCOCOC/C=C\C(OCOC)C(C)C
InChIInChI=1S/C11H22O4/c1-10(2)11(15-9-13-4)6-5-7-14-8-12-3/h5-6,10-11H,7-9H2,1-4H3/b6-5-
InChIKeyFDWYTDGKAUGPOA-WAYWQWQTSA-N
XLogP1.81
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.29
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[(E)-hept-4-en-3-yl] methyl carbonate
CID 11062874
(E)-1,1,3,6,8,8-hexamethoxy-2,7-dimethyloct-4-ene
CID 16050111
[(E)-5-(methoxymethoxy)-2,6-dimethylhept-3-en-2-yl] acetate
CID 11118275
[(E)-2,6-dimethylhept-4-en-3-yl] ethyl carbonate
CID 11608200
(E)-1,1-Diethoxy-4-methyl-pent-2-ene
CID 12865549
(E)-1-chloro-4-(methoxymethoxy)-5-methylhex-2-ene
CID 15652064
methyl [(4E)-6-methylhepta-1,4-dien-3-yl] carbonate
CID 101409400
methyl [(Z)-5-methylhex-2-enyl] carbonate
CID 101449661
(Z)-1,4-bis(methoxymethoxy)pent-2-ene
CID 134887207
(Z)-1-methoxy-4-(methoxymethoxy)pent-2-ene
CID 134887409
(E)-3-(2-bromo-1-ethoxyethoxy)-2-methyloct-4-ene
CID 134937705
(E)-3-(methoxymethoxy)-2,2-dimethyldec-4-ene
CID 134979482

Frequently Asked Questions

What is the IUPAC name of (Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene?
The IUPAC name of (Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene (CID 134898164) is (Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene.
What is the SMILES notation for (Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene?
The canonical SMILES for (Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene is COCOC/C=C\C(OCOC)C(C)C.
What is the InChIKey of (Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene?
The InChIKey is FDWYTDGKAUGPOA-WAYWQWQTSA-N. The full InChI is InChI=1S/C11H22O4/c1-10(2)11(15-9-13-4)6-5-7-14-8-12-3/h5-6,10-11H,7-9H2,1-4H3/b6-5-.
What are the key properties of (Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene?
(Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene has a molecular weight of 218.29 g/mol, XLogP of 1.81, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,4-bis(methoxymethoxy)-5-methylhex-2-ene is sourced from PubChem (CID 134898164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).