(1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol

C6H10O4 — CID 170000546

IUPAC(1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol
SMILESOC([C@@H]1CO1)[C@@H](O)[C@H]1CO1
InChIInChI=1S/C6H10O4/c7-5(3-1-9-3)6(8)4-2-10-4/h3-8H,1-2H2/t3-,4+,5+,6?/m1/s1
InChIKeyAAFJXZWCNVJTMK-OEXCPVAWSA-N
MW146.14 g/mol
LogP-1.49
Rot. Bonds3

About (1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol

(1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol (PubChem CID 170000546) has the molecular formula C6H10O4 and a molecular weight of 146.14 g/mol. Its IUPAC name is (1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol.

Molecular Properties

Compound Name(1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol
PubChem CID170000546
Molecular FormulaC6H10O4
Molecular Weight146.14 g/mol
Exact Mass146.06
IUPAC Name(1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol
SMILESOC([C@@H]1CO1)[C@@H](O)[C@H]1CO1
InChIInChI=1S/C6H10O4/c7-5(3-1-9-3)6(8)4-2-10-4/h3-8H,1-2H2/t3-,4+,5+,6?/m1/s1
InChIKeyAAFJXZWCNVJTMK-OEXCPVAWSA-N
XLogP-1.49
TPSA65.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.14
LogP ≤ 5-1.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze (1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S,2R)-1-[(2S)-(2,3-13C2)oxiran-2-yl]-2-[(2R)-(2,3-13C2)oxiran-2-yl](1,2-13C2)ethane-1,2-diol
CID 169439479
bis[(2S)-oxiran-2-yl]methanol
CID 13025415
(1S)-2-methyl-1-[(2S)-oxiran-2-yl]propan-1-ol
CID 12636241
(1S,2R)-3-methyl-1-[(2S)-oxiran-2-yl]butane-1,2-diol
CID 130928747
(2R,3S)-2,3-dihydroxy-3-[(2R)-oxiran-2-yl]propanamide
CID 55283902
(S)-cyclopropyl-[(2R)-oxiran-2-yl]methanol
CID 88929555
methoxy(oxiran-2-yl)methanol
CID 20559064
(1S)-2,2-dimethyl-1-[(2R)-oxiran-2-yl]propan-1-ol
CID 88929556
2-(oxiran-2-yl)propane-1,3-diol
CID 18506434
3-methyl-1-(oxiran-2-yl)butan-1-ol
CID 73110178
(2R,3S)-2-[(2R)-oxiran-2-yl]pentan-3-ol
CID 175884544
1-(oxiran-2-yl)but-3-en-1-ol
CID 11126217

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol?
The IUPAC name of (1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol (CID 170000546) is (1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol.
What is the SMILES notation for (1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol?
The canonical SMILES for (1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol is OC([C@@H]1CO1)[C@@H](O)[C@H]1CO1.
What is the InChIKey of (1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol?
The InChIKey is AAFJXZWCNVJTMK-OEXCPVAWSA-N. The full InChI is InChI=1S/C6H10O4/c7-5(3-1-9-3)6(8)4-2-10-4/h3-8H,1-2H2/t3-,4+,5+,6?/m1/s1.
What are the key properties of (1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol?
(1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol has a molecular weight of 146.14 g/mol, XLogP of -1.49, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[(2R)-oxiran-2-yl]-2-[(2S)-oxiran-2-yl]ethane-1,2-diol is sourced from PubChem (CID 170000546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).