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

C8H16O3 — CID 44516068

IUPAC(4R)-4-(methoxymethoxy)hex-1-en-3-ol
SMILESC=CC(O)[C@@H](CC)OCOC
InChIInChI=1S/C8H16O3/c1-4-7(9)8(5-2)11-6-10-3/h4,7-9H,1,5-6H2,2-3H3/t7?,8-/m1/s1
InChIKeySNAFPLSFBOSUJP-BRFYHDHCSA-N
MW160.21 g/mol
LogP0.93
Rot. Bonds6

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

(4R)-4-(methoxymethoxy)hex-1-en-3-ol (PubChem CID 44516068) has the molecular formula C8H16O3 and a molecular weight of 160.21 g/mol. Its IUPAC name is (4R)-4-(methoxymethoxy)hex-1-en-3-ol.

Molecular Properties

Compound Name(4R)-4-(methoxymethoxy)hex-1-en-3-ol
PubChem CID44516068
Molecular FormulaC8H16O3
Molecular Weight160.21 g/mol
Exact Mass160.11
IUPAC Name(4R)-4-(methoxymethoxy)hex-1-en-3-ol
SMILESC=CC(O)[C@@H](CC)OCOC
InChIInChI=1S/C8H16O3/c1-4-7(9)8(5-2)11-6-10-3/h4,7-9H,1,5-6H2,2-3H3/t7?,8-/m1/s1
InChIKeySNAFPLSFBOSUJP-BRFYHDHCSA-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

(1R)-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]prop-2-en-1-ol
CID 10583056
4-Penten-2-ol, 3-[(2-methoxyethoxy)methoxy]-, (2S,3S)-
CID 11424055
1-((S)-2,2-dimethyl-1,3-dioxolan-4-yl)prop-2-en-1-ol
CID 10419437
1-((R)-2,2-dimethyl-1,3-dioxolan-4-yl)prop-2-en-1-ol
CID 10920779
1,2-Dideoxy-4,5-O-(1-methylethylidene)pent-1-enitol
CID 13723233
(2E,4R,5S,6E)-4-(methoxymethoxy)undeca-2,6-dien-5-ol
CID 10466332
1,2-Dideoxy-4,5-O-(1-methylethylidene)-D-erythro-pent-1-enitol
CID 11094894
(1S)-1-[(4S,5R)-5-ethenyl-2,2-dimethyl-1,3-dioxolan-4-yl]prop-2-en-1-ol
CID 11745296
(1R)-1-[(4S,5R)-5-ethenyl-2,2-dimethyl-1,3-dioxolan-4-yl]prop-2-en-1-ol
CID 11805416
4-(Methoxymethoxy)hex-5-en-3-ol
CID 12916897
4-(Methoxymethoxy)-2-methylhex-5-en-3-ol
CID 12916901
3-(Methoxymethoxy)oct-1-en-4-ol
CID 13025034

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(methoxymethoxy)hex-1-en-3-ol?
The IUPAC name of (4R)-4-(methoxymethoxy)hex-1-en-3-ol (CID 44516068) is (4R)-4-(methoxymethoxy)hex-1-en-3-ol.
What is the SMILES notation for (4R)-4-(methoxymethoxy)hex-1-en-3-ol?
The canonical SMILES for (4R)-4-(methoxymethoxy)hex-1-en-3-ol is C=CC(O)[C@@H](CC)OCOC.
What is the InChIKey of (4R)-4-(methoxymethoxy)hex-1-en-3-ol?
The InChIKey is SNAFPLSFBOSUJP-BRFYHDHCSA-N. The full InChI is InChI=1S/C8H16O3/c1-4-7(9)8(5-2)11-6-10-3/h4,7-9H,1,5-6H2,2-3H3/t7?,8-/m1/s1.
What are the key properties of (4R)-4-(methoxymethoxy)hex-1-en-3-ol?
(4R)-4-(methoxymethoxy)hex-1-en-3-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 (4R)-4-(methoxymethoxy)hex-1-en-3-ol is sourced from PubChem (CID 44516068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).