(E)-1-(methoxymethoxy)oct-1-en-3-ol

C10H20O3 — CID 11745383

IUPAC(E)-1-(methoxymethoxy)oct-1-en-3-ol
SMILESCCCCCC(O)/C=C/OCOC
InChIInChI=1S/C10H20O3/c1-3-4-5-6-10(11)7-8-13-9-12-2/h7-8,10-11H,3-6,9H2,1-2H3/b8-7+
InChIKeyDYBVGSPNTMIIAF-BQYQJAHWSA-N
MW188.27 g/mol
LogP2.06
Rot. Bonds8

About (E)-1-(methoxymethoxy)oct-1-en-3-ol

(E)-1-(methoxymethoxy)oct-1-en-3-ol (PubChem CID 11745383) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is (E)-1-(methoxymethoxy)oct-1-en-3-ol.

Molecular Properties

Compound Name(E)-1-(methoxymethoxy)oct-1-en-3-ol
PubChem CID11745383
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name(E)-1-(methoxymethoxy)oct-1-en-3-ol
SMILESCCCCCC(O)/C=C/OCOC
InChIInChI=1S/C10H20O3/c1-3-4-5-6-10(11)7-8-13-9-12-2/h7-8,10-11H,3-6,9H2,1-2H3/b8-7+
InChIKeyDYBVGSPNTMIIAF-BQYQJAHWSA-N
XLogP2.06
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl (E,4S)-4-hydroxynon-2-enoate
CID 169408597
(E,4S)-1,1-dimethoxyundec-2-en-4-ol
CID 10585572
methyl (E,12R,15S)-12,15-dihydroxydocos-13-enoate
CID 10022931
(Z)-1-[(4-methoxyphenyl)methoxy]oct-1-en-3-ol
CID 10587712
(E,3S)-1-iodooct-1-en-3-ol
CID 10988815
(E)-1-chlorooct-1-en-3-ol
CID 14723484
(3S)-1-iodooct-1-en-3-ol
CID 54007858
(3R)-1-iodooct-1-en-3-ol
CID 54007857
(Z)-undec-2-en-4-ol
CID 14320443
(E,3S)-1-triethylsilyloct-1-en-3-ol
CID 10377101
methyl (E)-2-acetamido-5-hydroxydodec-3-enoate
CID 58572061
(E)-non-2-ene-1,4-diol
CID 14106146

Frequently Asked Questions

What is the IUPAC name of (E)-1-(methoxymethoxy)oct-1-en-3-ol?
The IUPAC name of (E)-1-(methoxymethoxy)oct-1-en-3-ol (CID 11745383) is (E)-1-(methoxymethoxy)oct-1-en-3-ol.
What is the SMILES notation for (E)-1-(methoxymethoxy)oct-1-en-3-ol?
The canonical SMILES for (E)-1-(methoxymethoxy)oct-1-en-3-ol is CCCCCC(O)/C=C/OCOC.
What is the InChIKey of (E)-1-(methoxymethoxy)oct-1-en-3-ol?
The InChIKey is DYBVGSPNTMIIAF-BQYQJAHWSA-N. The full InChI is InChI=1S/C10H20O3/c1-3-4-5-6-10(11)7-8-13-9-12-2/h7-8,10-11H,3-6,9H2,1-2H3/b8-7+.
What are the key properties of (E)-1-(methoxymethoxy)oct-1-en-3-ol?
(E)-1-(methoxymethoxy)oct-1-en-3-ol has a molecular weight of 188.27 g/mol, XLogP of 2.06, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(methoxymethoxy)oct-1-en-3-ol is sourced from PubChem (CID 11745383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).