methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate

C8H16O6 — CID 76960533

IUPACmethyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate
SMILESCOC(=O)[C@@H](C)O.COC(=O)[C@H](C)O
InChIInChI=1S/2C4H8O3/c2*1-3(5)4(6)7-2/h2*3,5H,1-2H3/t2*3-/m10/s1
InChIKeyXJIZJTVJBJMKLH-OASOTCBPSA-N
MW208.21 g/mol
LogP-0.92
Rot. Bonds2

About methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate

methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate (PubChem CID 76960533) has the molecular formula C8H16O6 and a molecular weight of 208.21 g/mol. Its IUPAC name is methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate.

Molecular Properties

Compound Namemethyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate
PubChem CID76960533
Molecular FormulaC8H16O6
Molecular Weight208.21 g/mol
Exact Mass208.09
IUPAC Namemethyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate
SMILESCOC(=O)[C@@H](C)O.COC(=O)[C@H](C)O
InChIInChI=1S/2C4H8O3/c2*1-3(5)4(6)7-2/h2*3,5H,1-2H3/t2*3-/m10/s1
InChIKeyXJIZJTVJBJMKLH-OASOTCBPSA-N
XLogP-0.92
TPSA93.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.21
LogP ≤ 5-0.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate 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

methyl (2S)-2-hydroxypropanoate;hydrochloride
CID 88631623
methyl 2-hydroxypropanoate;hydrochloride
CID 87417627
methanol;methyl 2-hydroxypropanoate
CID 157321309
methyl (2R)-2-fluoropropanoate;methyl (2S)-2-hydroxypropanoate
CID 159507124
2-hydroxy-2-methylpropanoic acid;methyl 2-hydroxypropanoate
CID 159015634
1-ethoxypropan-2-ol;methyl 2-hydroxypropanoate
CID 87696230
methyl 2-aminopropanoate
CID 159707893
methyl 2-methylpropanoate;titanium
CID 174633551
(2-methoxy-2-oxoethyl) 2-hydroxypropanoate
CID 19788816
methyl 3-amino-2-hydroxybutanoate;hydrochloride
CID 135262653
methyl 2-methoxypropanoate;hydrochloride
CID 174449160
tetramethyl 2-methylpropane-1,1,3,3-tetracarboxylate
CID 2192496

Frequently Asked Questions

What is the IUPAC name of methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate?
The IUPAC name of methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate (CID 76960533) is methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate.
What is the SMILES notation for methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate?
The canonical SMILES for methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate is COC(=O)[C@@H](C)O.COC(=O)[C@H](C)O.
What is the InChIKey of methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate?
The InChIKey is XJIZJTVJBJMKLH-OASOTCBPSA-N. The full InChI is InChI=1S/2C4H8O3/c2*1-3(5)4(6)7-2/h2*3,5H,1-2H3/t2*3-/m10/s1.
What are the key properties of methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate?
methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate has a molecular weight of 208.21 g/mol, XLogP of -0.92, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2R)-2-hydroxypropanoate;methyl (2S)-2-hydroxypropanoate is sourced from PubChem (CID 76960533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).