(8S)-8-(methoxymethoxy)dec-9-en-1-ol

C12H24O3 — CID 24862520

IUPAC(8S)-8-(methoxymethoxy)dec-9-en-1-ol
SMILESC=C[C@H](CCCCCCCO)OCOC
InChIInChI=1S/C12H24O3/c1-3-12(15-11-14-2)9-7-5-4-6-8-10-13/h3,12-13H,1,4-11H2,2H3/t12-/m1/s1
InChIKeyQMSJCEANRNHQTG-GFCCVEGCSA-N
MW216.32 g/mol
LogP2.49
Rot. Bonds11

About (8S)-8-(methoxymethoxy)dec-9-en-1-ol

(8S)-8-(methoxymethoxy)dec-9-en-1-ol (PubChem CID 24862520) has the molecular formula C12H24O3 and a molecular weight of 216.32 g/mol. Its IUPAC name is (8S)-8-(methoxymethoxy)dec-9-en-1-ol.

Molecular Properties

Compound Name(8S)-8-(methoxymethoxy)dec-9-en-1-ol
PubChem CID24862520
Molecular FormulaC12H24O3
Molecular Weight216.32 g/mol
Exact Mass216.17
IUPAC Name(8S)-8-(methoxymethoxy)dec-9-en-1-ol
SMILESC=C[C@H](CCCCCCCO)OCOC
InChIInChI=1S/C12H24O3/c1-3-12(15-11-14-2)9-7-5-4-6-8-10-13/h3,12-13H,1,4-11H2,2H3/t12-/m1/s1
InChIKeyQMSJCEANRNHQTG-GFCCVEGCSA-N
XLogP2.49
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

3-(methoxymethoxy)oct-1-ene;oct-1-en-3-ol
CID 161465176
2-[(7S)-7-(methoxymethoxy)non-8-enyl]oxirane
CID 24862521
(2S)-2-[(7S)-7-(methoxymethoxy)non-8-enyl]oxirane
CID 24862522
(2R,5R)-5-(methoxymethoxy)hept-6-en-2-ol
CID 44604186
(5S)-5-(methoxymethoxy)hexadecan-1-ol
CID 134973522
ethyl 7-(methoxymethoxy)-3-oxonon-8-enoate
CID 118179619
3-propoxynonadec-1-ene
CID 87204997
3-methoxynon-1-ene
CID 12563924
3-oct-1-en-3-yloxyoct-1-ene
CID 21413587
(3R)-3-(methoxymethoxy)pent-4-en-2-one
CID 102143717
4-phenylmethoxyhex-5-en-1-ol
CID 25098808
hept-6-ene-1,5-diol
CID 13479548

Frequently Asked Questions

What is the IUPAC name of (8S)-8-(methoxymethoxy)dec-9-en-1-ol?
The IUPAC name of (8S)-8-(methoxymethoxy)dec-9-en-1-ol (CID 24862520) is (8S)-8-(methoxymethoxy)dec-9-en-1-ol.
What is the SMILES notation for (8S)-8-(methoxymethoxy)dec-9-en-1-ol?
The canonical SMILES for (8S)-8-(methoxymethoxy)dec-9-en-1-ol is C=C[C@H](CCCCCCCO)OCOC.
What is the InChIKey of (8S)-8-(methoxymethoxy)dec-9-en-1-ol?
The InChIKey is QMSJCEANRNHQTG-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H24O3/c1-3-12(15-11-14-2)9-7-5-4-6-8-10-13/h3,12-13H,1,4-11H2,2H3/t12-/m1/s1.
What are the key properties of (8S)-8-(methoxymethoxy)dec-9-en-1-ol?
(8S)-8-(methoxymethoxy)dec-9-en-1-ol has a molecular weight of 216.32 g/mol, XLogP of 2.49, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8S)-8-(methoxymethoxy)dec-9-en-1-ol is sourced from PubChem (CID 24862520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).