(E)-3-(methoxymethoxy)hex-4-en-1-ol

C8H16O3 — CID 10419470

IUPAC(E)-3-(methoxymethoxy)hex-4-en-1-ol
SMILESC/C=C/C(CCO)OCOC
InChIInChI=1S/C8H16O3/c1-3-4-8(5-6-9)11-7-10-2/h3-4,8-9H,5-7H2,1-2H3/b4-3+
InChIKeyFTQURTVDIUUJGM-ONEGZZNKSA-N
MW160.21 g/mol
LogP0.93
Rot. Bonds6

About (E)-3-(methoxymethoxy)hex-4-en-1-ol

(E)-3-(methoxymethoxy)hex-4-en-1-ol (PubChem CID 10419470) has the molecular formula C8H16O3 and a molecular weight of 160.21 g/mol. Its IUPAC name is (E)-3-(methoxymethoxy)hex-4-en-1-ol.

Molecular Properties

Compound Name(E)-3-(methoxymethoxy)hex-4-en-1-ol
PubChem CID10419470
Molecular FormulaC8H16O3
Molecular Weight160.21 g/mol
Exact Mass160.11
IUPAC Name(E)-3-(methoxymethoxy)hex-4-en-1-ol
SMILESC/C=C/C(CCO)OCOC
InChIInChI=1S/C8H16O3/c1-3-4-8(5-6-9)11-7-10-2/h3-4,8-9H,5-7H2,1-2H3/b4-3+
InChIKeyFTQURTVDIUUJGM-ONEGZZNKSA-N
XLogP0.93
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.21
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

[(2R,6R)-6-propan-2-yloxy-3,6-dihydro-2H-pyran-2-yl]methanol
CID 11788550
(3R)-3-(methoxymethoxy)pent-4-en-1-ol
CID 46192663
(2R,4S)-4-(methoxymethoxy)hex-5-en-2-ol
CID 56834401
4-Nonene, 1,1,3-triethoxy-
CID 6450414
3-Heptene, 5,7,7-triethoxy-
CID 53438979
Pentenyl-1,3-dioxolane-4-methanol, (E)-
CID 69669515
[2-(Pent-1-en-1-yl)-1,3-dioxolan-4-yl]methanol
CID 69669516
(2e)-1,1-Dimethoxyhex-2-en-4-ol
CID 11019160
(5E)-3-(methoxymethoxy)hepta-1,5-dien-4-ol
CID 13025036
(E,2S)-4-(methoxymethoxymethyl)hex-3-en-2-ol
CID 60153429
1,1-Diathoxy-4-hydroxy-2-penten
CID 85393239
3-Ethoxy-4-hexenal diethyl acetal
CID 85858550

Frequently Asked Questions

What is the IUPAC name of (E)-3-(methoxymethoxy)hex-4-en-1-ol?
The IUPAC name of (E)-3-(methoxymethoxy)hex-4-en-1-ol (CID 10419470) is (E)-3-(methoxymethoxy)hex-4-en-1-ol.
What is the SMILES notation for (E)-3-(methoxymethoxy)hex-4-en-1-ol?
The canonical SMILES for (E)-3-(methoxymethoxy)hex-4-en-1-ol is C/C=C/C(CCO)OCOC.
What is the InChIKey of (E)-3-(methoxymethoxy)hex-4-en-1-ol?
The InChIKey is FTQURTVDIUUJGM-ONEGZZNKSA-N. The full InChI is InChI=1S/C8H16O3/c1-3-4-8(5-6-9)11-7-10-2/h3-4,8-9H,5-7H2,1-2H3/b4-3+.
What are the key properties of (E)-3-(methoxymethoxy)hex-4-en-1-ol?
(E)-3-(methoxymethoxy)hex-4-en-1-ol has a molecular weight of 160.21 g/mol, XLogP of 0.93, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(methoxymethoxy)hex-4-en-1-ol is sourced from PubChem (CID 10419470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).