methyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate

C8H14O4 — CID 67130803

IUPACmethyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate
SMILESCOC(=O)C(O)C[C@H]1CCCO1
InChIInChI=1S/C8H14O4/c1-11-8(10)7(9)5-6-3-2-4-12-6/h6-7,9H,2-5H2,1H3/t6-,7?/m1/s1
InChIKeyVIKSMTOVCQIRCO-ULUSZKPHSA-N
MW174.20 g/mol
LogP0.09
Rot. Bonds3

About methyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate

methyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate (PubChem CID 67130803) has the molecular formula C8H14O4 and a molecular weight of 174.20 g/mol. Its IUPAC name is methyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate.

Molecular Properties

Compound Namemethyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate
PubChem CID67130803
Molecular FormulaC8H14O4
Molecular Weight174.20 g/mol
Exact Mass174.09
IUPAC Namemethyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate
SMILESCOC(=O)C(O)C[C@H]1CCCO1
InChIInChI=1S/C8H14O4/c1-11-8(10)7(9)5-6-3-2-4-12-6/h6-7,9H,2-5H2,1H3/t6-,7?/m1/s1
InChIKeyVIKSMTOVCQIRCO-ULUSZKPHSA-N
XLogP0.09
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-hydroxy-3-(oxolan-2-yl)propanoate
CID 11788721
methyl 3-(oxolan-2-yl)-2-(trifluoromethylsulfonyloxy)propanoate
CID 76786035
dipropan-2-yl 2-(oxolan-2-ylmethyl)propanedioate
CID 103972667
methyl 3-methyl-2-(oxolan-2-ylmethylamino)butanoate
CID 43386449
methyl 2-methyl-3-(oxolan-2-ylmethylamino)butanoate
CID 79391941
methyl (2R)-3-(1,3-dioxetan-2-yl)-2-hydroxypropanoate
CID 89008625
methyl (2S)-2-methyl-4-oxo-4-[[(2S)-oxolan-2-yl]methylamino]butanoate
CID 97019343
methyl 2-cyclopropyl-2-(oxolan-2-ylmethylsulfonyl)acetate
CID 106493674
3-(oxolan-2-yl)-2-(oxolan-2-ylmethyl)propanoic acid
CID 14391738
[(2R)-oxolan-2-yl]methyl propanoate
CID 36691172
(2R)-2-amino-3-[(2R)-oxolan-2-yl]propanoic acid;hydrochloride
CID 155943705
1-methoxy-3-(oxolan-2-yl)propan-2-amine
CID 62604472

Frequently Asked Questions

What is the IUPAC name of methyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate?
The IUPAC name of methyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate (CID 67130803) is methyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate.
What is the SMILES notation for methyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate?
The canonical SMILES for methyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate is COC(=O)C(O)C[C@H]1CCCO1.
What is the InChIKey of methyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate?
The InChIKey is VIKSMTOVCQIRCO-ULUSZKPHSA-N. The full InChI is InChI=1S/C8H14O4/c1-11-8(10)7(9)5-6-3-2-4-12-6/h6-7,9H,2-5H2,1H3/t6-,7?/m1/s1.
What are the key properties of methyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate?
methyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate has a molecular weight of 174.20 g/mol, XLogP of 0.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-hydroxy-3-[(2R)-oxolan-2-yl]propanoate is sourced from PubChem (CID 67130803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).