ethyl (2R)-2-hydroxypropanoate

C5H10O3 — CID 637513

IUPACethyl (2R)-2-hydroxypropanoate
SMILESCCOC(=O)[C@@H](C)O
InChIInChI=1S/C5H10O3/c1-3-8-5(7)4(2)6/h4,6H,3H2,1-2H3/t4-/m1/s1
InChIKeyLZCLXQDLBQLTDK-SCSAIBSYSA-N
MW118.13 g/mol
LogP-0.07
Rot. Bonds2

About ethyl (2R)-2-hydroxypropanoate

ethyl (2R)-2-hydroxypropanoate (PubChem CID 637513) has the molecular formula C5H10O3 and a molecular weight of 118.13 g/mol. Its IUPAC name is ethyl (2R)-2-hydroxypropanoate.

Molecular Properties

Compound Nameethyl (2R)-2-hydroxypropanoate
PubChem CID637513
Molecular FormulaC5H10O3
Molecular Weight118.13 g/mol
Exact Mass118.06
IUPAC Nameethyl (2R)-2-hydroxypropanoate
SMILESCCOC(=O)[C@@H](C)O
InChIInChI=1S/C5H10O3/c1-3-8-5(7)4(2)6/h4,6H,3H2,1-2H3/t4-/m1/s1
InChIKeyLZCLXQDLBQLTDK-SCSAIBSYSA-N
XLogP-0.07
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.13
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl (2R)-2-hydroxypropanoate?
The IUPAC name of ethyl (2R)-2-hydroxypropanoate (CID 637513) is ethyl (2R)-2-hydroxypropanoate.
What is the SMILES notation for ethyl (2R)-2-hydroxypropanoate?
The canonical SMILES for ethyl (2R)-2-hydroxypropanoate is CCOC(=O)[C@@H](C)O.
What is the InChIKey of ethyl (2R)-2-hydroxypropanoate?
The InChIKey is LZCLXQDLBQLTDK-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H10O3/c1-3-8-5(7)4(2)6/h4,6H,3H2,1-2H3/t4-/m1/s1.
What are the key properties of ethyl (2R)-2-hydroxypropanoate?
ethyl (2R)-2-hydroxypropanoate has a molecular weight of 118.13 g/mol, XLogP of -0.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl (2R)-2-hydroxypropanoate is sourced from PubChem (CID 637513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).