actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol

C8H16AcO2 — CID 59063588

IUPACactinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol
SMILESCC[C@@H]1O[C@H](O)[C@H](C)C1C.[Ac]
InChIInChI=1S/C8H16O2.Ac/c1-4-7-5(2)6(3)8(9)10-7;/h5-9H,4H2,1-3H3;/t5?,6-,7+,8+;/m1./s1
InChIKeyFHKPVPHDNHYLCA-CAXFZPNWSA-N
MW371.21 g/mol
LogP1.39
Rot. Bonds1

About actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol

actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol (PubChem CID 59063588) has the molecular formula C8H16AcO2 and a molecular weight of 371.21 g/mol. Its IUPAC name is actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol.

Molecular Properties

Compound Nameactinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol
PubChem CID59063588
Molecular FormulaC8H16AcO2
Molecular Weight371.21 g/mol
Exact Mass371.14
IUPAC Nameactinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol
SMILESCC[C@@H]1O[C@H](O)[C@H](C)C1C.[Ac]
InChIInChI=1S/C8H16O2.Ac/c1-4-7-5(2)6(3)8(9)10-7;/h5-9H,4H2,1-3H3;/t5?,6-,7+,8+;/m1./s1
InChIKeyFHKPVPHDNHYLCA-CAXFZPNWSA-N
XLogP1.39
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.21
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol
CID 59063589
5-ethyl-4-methyloxolane-2,3-diol
CID 21338247
(4S,5S)-6-ethyl-4-methyloxane-2,3,5-triol
CID 90429062
(2R,4S,5R)-6-ethyl-3,5-dimethyl-4-propan-2-yloxyoxan-2-ol
CID 126764279
(2S,3S)-2-ethyl-3,4,5-trimethyloxolane
CID 59088156
(3R,4S,5R)-5-ethyloxolane-2,3,4-triol
CID 59169178
(2S,3R,4S,5S,6R)-2-ethyl-3,4,5,6-tetramethyloxane
CID 59944457
(3S,4R,6S)-2-ethyl-3,4,5,6-tetramethyloxane
CID 91273556
(3S,6S)-2-ethyl-3,4,5,6-tetramethyloxane
CID 91456258
(3R,4S,6S)-2-ethyl-3,4,5,6-tetramethyloxane
CID 90919001
(3R,5S)-6-ethyl-2,5-dimethyloxane-3,4-diol
CID 142172464
(3R,4S,5R,6R)-6-(hydroxymethyl)-3,4-dimethyloxane-2,5-diol
CID 90247742

Frequently Asked Questions

What is the IUPAC name of actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol?
The IUPAC name of actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol (CID 59063588) is actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol.
What is the SMILES notation for actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol?
The canonical SMILES for actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol is CC[C@@H]1O[C@H](O)[C@H](C)C1C.[Ac].
What is the InChIKey of actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol?
The InChIKey is FHKPVPHDNHYLCA-CAXFZPNWSA-N. The full InChI is InChI=1S/C8H16O2.Ac/c1-4-7-5(2)6(3)8(9)10-7;/h5-9H,4H2,1-3H3;/t5?,6-,7+,8+;/m1./s1.
What are the key properties of actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol?
actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol has a molecular weight of 371.21 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for actinium;(2S,3R,5S)-5-ethyl-3,4-dimethyloxolan-2-ol is sourced from PubChem (CID 59063588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).