(2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol

C10H20O6 — CID 141460109

IUPAC(2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol
SMILESCC=CCC(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
InChIInChI=1S/C10H20O6/c1-2-3-4-6(12)8(14)10(16)9(15)7(13)5-11/h2-3,6-16H,4-5H2,1H3/t6?,7-,8+,9-,10-/m1/s1
InChIKeyALCQJSZYYDTOGN-JNSGDMPLSA-N
MW236.26 g/mol
LogP-2.25
Rot. Bonds7

About (2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol

(2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol (PubChem CID 141460109) has the molecular formula C10H20O6 and a molecular weight of 236.26 g/mol. Its IUPAC name is (2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol.

Molecular Properties

Compound Name(2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol
PubChem CID141460109
Molecular FormulaC10H20O6
Molecular Weight236.26 g/mol
Exact Mass236.13
IUPAC Name(2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol
SMILESCC=CCC(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
InChIInChI=1S/C10H20O6/c1-2-3-4-6(12)8(14)10(16)9(15)7(13)5-11/h2-3,6-16H,4-5H2,1H3/t6?,7-,8+,9-,10-/m1/s1
InChIKeyALCQJSZYYDTOGN-JNSGDMPLSA-N
XLogP-2.25
TPSA121.38 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500236.26
LogP ≤ 5-2.25
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol with MolForge

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Related Compounds

(3R,5R,6R)-heptane-1,2,3,4,5,6,7-heptol
CID 87483282
(2R,3R,4R,5S,6R)-non-8-ene-1,2,3,4,5,6-hexol
CID 87557711
heptane-1,2,3,4,5,6,7-heptol;hydrochloride
CID 126649386
hexane-1,2,3,4,5,6-hexol;methanol
CID 174767977
heptane-1,2,3,4,5,6,7-heptol;hydroiodide
CID 126649290
(2S,3S,4S,5S)-hexane-1,2,3,4,5,6-hexol;(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol
CID 135394797
(2R,5S)-hexane-1,2,3,4,5,6-hexol
CID 88909362
(2R,3S,4S,5R)-hexane-1,2,3,4,5,6-hexol;(2R,3S,4R,5R)-hexane-1,2,3,4,5,6-hexol
CID 87912891
(E)-2-methylhept-5-en-3-ol
CID 12592438
(2R,3R,4R)-oct-7-ene-1,2,3,4,5-pentol
CID 134906193
(2R,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol;iron
CID 173421469
(2R,3R,4R,5R)-hexane-1,2,3,4,5,6-hexol;methane
CID 155195650

Frequently Asked Questions

What is the IUPAC name of (2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol?
The IUPAC name of (2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol (CID 141460109) is (2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol.
What is the SMILES notation for (2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol?
The canonical SMILES for (2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol is CC=CCC(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.
What is the InChIKey of (2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol?
The InChIKey is ALCQJSZYYDTOGN-JNSGDMPLSA-N. The full InChI is InChI=1S/C10H20O6/c1-2-3-4-6(12)8(14)10(16)9(15)7(13)5-11/h2-3,6-16H,4-5H2,1H3/t6?,7-,8+,9-,10-/m1/s1.
What are the key properties of (2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol?
(2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol has a molecular weight of 236.26 g/mol, XLogP of -2.25, 7 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R,4R,5S)-dec-8-ene-1,2,3,4,5,6-hexol is sourced from PubChem (CID 141460109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).