methyl 2-(2-hydroxyethoxy)propanoate

C6H12O4 — CID 15099863

IUPACmethyl 2-(2-hydroxyethoxy)propanoate
SMILESCOC(=O)C(C)OCCO
InChIInChI=1S/C6H12O4/c1-5(6(8)9-2)10-4-3-7/h5,7H,3-4H2,1-2H3
InChIKeyJAHSVQOWXUFCIF-UHFFFAOYSA-N
MW148.16 g/mol
LogP-0.44
Rot. Bonds4

About methyl 2-(2-hydroxyethoxy)propanoate

methyl 2-(2-hydroxyethoxy)propanoate (PubChem CID 15099863) has the molecular formula C6H12O4 and a molecular weight of 148.16 g/mol. Its IUPAC name is methyl 2-(2-hydroxyethoxy)propanoate.

Molecular Properties

Compound Namemethyl 2-(2-hydroxyethoxy)propanoate
PubChem CID15099863
Molecular FormulaC6H12O4
Molecular Weight148.16 g/mol
Exact Mass148.07
IUPAC Namemethyl 2-(2-hydroxyethoxy)propanoate
SMILESCOC(=O)C(C)OCCO
InChIInChI=1S/C6H12O4/c1-5(6(8)9-2)10-4-3-7/h5,7H,3-4H2,1-2H3
InChIKeyJAHSVQOWXUFCIF-UHFFFAOYSA-N
XLogP-0.44
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze methyl 2-(2-hydroxyethoxy)propanoate 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 2-(2-aminoethoxy)propanoate;hydrochloride
CID 175589324
methyl 2-(2-ethoxyethoxy)propanoate
CID 61234478
methyl (2S)-2-(3-methylbut-3-enoxy)propanoate
CID 103338255
methyl (2S)-2-hexoxypropanoate
CID 103337819
methyl 2-dodecoxypropanoate
CID 86244254
2-(2-hydroxyethoxy)propanoate
CID 19884519
methyl (2R)-2-(2-butoxyethoxy)propanoate
CID 103337806
tetrakis(2-hydroxyethyl methyl carbonate);methane;tetrakis(yttrium)
CID 158329975
methyl 2-(2-cyclobutylethoxy)propanoate
CID 106199364
methyl 2-methoxypropanoate;hydrochloride
CID 174449160
methyl (2R)-2-(3-phenylpropoxy)propanoate
CID 103337959
methyl (2S)-2-(3-phenylpropoxy)propanoate
CID 103337960

Frequently Asked Questions

What is the IUPAC name of methyl 2-(2-hydroxyethoxy)propanoate?
The IUPAC name of methyl 2-(2-hydroxyethoxy)propanoate (CID 15099863) is methyl 2-(2-hydroxyethoxy)propanoate.
What is the SMILES notation for methyl 2-(2-hydroxyethoxy)propanoate?
The canonical SMILES for methyl 2-(2-hydroxyethoxy)propanoate is COC(=O)C(C)OCCO.
What is the InChIKey of methyl 2-(2-hydroxyethoxy)propanoate?
The InChIKey is JAHSVQOWXUFCIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O4/c1-5(6(8)9-2)10-4-3-7/h5,7H,3-4H2,1-2H3.
What are the key properties of methyl 2-(2-hydroxyethoxy)propanoate?
methyl 2-(2-hydroxyethoxy)propanoate has a molecular weight of 148.16 g/mol, XLogP of -0.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(2-hydroxyethoxy)propanoate is sourced from PubChem (CID 15099863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).