(4R)-4-(methoxymethoxy)hex-5-en-1-ol

C8H16O3 — CID 122548096

IUPAC(4R)-4-(methoxymethoxy)hex-5-en-1-ol
SMILESC=C[C@@H](CCCO)OCOC
InChIInChI=1S/C8H16O3/c1-3-8(5-4-6-9)11-7-10-2/h3,8-9H,1,4-7H2,2H3/t8-/m0/s1
InChIKeyZQWBZQYAWIEBAW-QMMMGPOBSA-N
MW160.21 g/mol
LogP0.93
Rot. Bonds7

About (4R)-4-(methoxymethoxy)hex-5-en-1-ol

(4R)-4-(methoxymethoxy)hex-5-en-1-ol (PubChem CID 122548096) has the molecular formula C8H16O3 and a molecular weight of 160.21 g/mol. Its IUPAC name is (4R)-4-(methoxymethoxy)hex-5-en-1-ol.

Molecular Properties

Compound Name(4R)-4-(methoxymethoxy)hex-5-en-1-ol
PubChem CID122548096
Molecular FormulaC8H16O3
Molecular Weight160.21 g/mol
Exact Mass160.11
IUPAC Name(4R)-4-(methoxymethoxy)hex-5-en-1-ol
SMILESC=C[C@@H](CCCO)OCOC
InChIInChI=1S/C8H16O3/c1-3-8(5-4-6-9)11-7-10-2/h3,8-9H,1,4-7H2,2H3/t8-/m0/s1
InChIKeyZQWBZQYAWIEBAW-QMMMGPOBSA-N
XLogP0.93
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
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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Frequently Asked Questions

What is the IUPAC name of (4R)-4-(methoxymethoxy)hex-5-en-1-ol?
The IUPAC name of (4R)-4-(methoxymethoxy)hex-5-en-1-ol (CID 122548096) is (4R)-4-(methoxymethoxy)hex-5-en-1-ol.
What is the SMILES notation for (4R)-4-(methoxymethoxy)hex-5-en-1-ol?
The canonical SMILES for (4R)-4-(methoxymethoxy)hex-5-en-1-ol is C=C[C@@H](CCCO)OCOC.
What is the InChIKey of (4R)-4-(methoxymethoxy)hex-5-en-1-ol?
The InChIKey is ZQWBZQYAWIEBAW-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H16O3/c1-3-8(5-4-6-9)11-7-10-2/h3,8-9H,1,4-7H2,2H3/t8-/m0/s1.
What are the key properties of (4R)-4-(methoxymethoxy)hex-5-en-1-ol?
(4R)-4-(methoxymethoxy)hex-5-en-1-ol has a molecular weight of 160.21 g/mol, XLogP of 0.93, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(methoxymethoxy)hex-5-en-1-ol is sourced from PubChem (CID 122548096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).