(4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one

C6H10O5 — CID 143150589

IUPAC(4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one
SMILESO=C1OC(CCO)[C@@H](O)C1O
InChIInChI=1S/C6H10O5/c7-2-1-3-4(8)5(9)6(10)11-3/h3-5,7-9H,1-2H2/t3?,4-,5?/m1/s1
InChIKeyBAKBOLGADIKZRT-ACHVEOLNSA-N
MW162.14 g/mol
LogP-1.98
Rot. Bonds2

About (4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one

(4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one (PubChem CID 143150589) has the molecular formula C6H10O5 and a molecular weight of 162.14 g/mol. Its IUPAC name is (4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one.

Molecular Properties

Compound Name(4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one
PubChem CID143150589
Molecular FormulaC6H10O5
Molecular Weight162.14 g/mol
Exact Mass162.05
IUPAC Name(4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one
SMILESO=C1OC(CCO)[C@@H](O)C1O
InChIInChI=1S/C6H10O5/c7-2-1-3-4(8)5(9)6(10)11-3/h3-5,7-9H,1-2H2/t3?,4-,5?/m1/s1
InChIKeyBAKBOLGADIKZRT-ACHVEOLNSA-N
XLogP-1.98
TPSA86.99 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.14
LogP ≤ 5-1.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

(3S,4R)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one
CID 143531523
(3S,4S,5S)-5-but-3-enyl-3,4-dihydroxyoxolan-2-one
CID 130918136
(3S,4S,5S)-5-(chloromethyl)-3,4-dihydroxyoxolan-2-one
CID 55298555
5-(bromomethyl)-3,4-dihydroxyoxolan-2-one
CID 75089328
(3R,4R,5S)-5-(chloromethyl)-3,4-dihydroxyoxolan-2-one
CID 55298554
(4S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-one
CID 148905339
3,4-dihydroxy-5-tricosyloxolan-2-one
CID 78384597
(3R,4S,5S,6R)-6-[deuterio(hydroxy)methyl]-3,4,5-trihydroxyoxan-2-one
CID 175929927
(4R,5R)-3,4-dihydroxy-5-(2-methylpropyl)oxolan-2-one
CID 58151972
(4R,5S,6R)-5-fluoro-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-one
CID 91410550
6-ethyl-3,4,5-trihydroxyoxan-2-one
CID 123675946
(3S,4R,5R)-5-(azidomethyl)-3,4-dihydroxyoxolan-2-one
CID 130863136

Frequently Asked Questions

What is the IUPAC name of (4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one?
The IUPAC name of (4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one (CID 143150589) is (4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one.
What is the SMILES notation for (4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one?
The canonical SMILES for (4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one is O=C1OC(CCO)[C@@H](O)C1O.
What is the InChIKey of (4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one?
The InChIKey is BAKBOLGADIKZRT-ACHVEOLNSA-N. The full InChI is InChI=1S/C6H10O5/c7-2-1-3-4(8)5(9)6(10)11-3/h3-5,7-9H,1-2H2/t3?,4-,5?/m1/s1.
What are the key properties of (4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one?
(4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one has a molecular weight of 162.14 g/mol, XLogP of -1.98, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-3,4-dihydroxy-5-(2-hydroxyethyl)oxolan-2-one is sourced from PubChem (CID 143150589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).