2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid

C7H10O7 — CID 59117352

IUPAC2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid
SMILESCC(O)C(=O)OCC(=O)OCC(=O)O
InChIInChI=1S/C7H10O7/c1-4(8)7(12)14-3-6(11)13-2-5(9)10/h4,8H,2-3H2,1H3,(H,9,10)
InChIKeyMTSWYZDLIKYZDW-UHFFFAOYSA-N
MW206.15 g/mol
LogP-1.46
Rot. Bonds5

About 2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid

2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid (PubChem CID 59117352) has the molecular formula C7H10O7 and a molecular weight of 206.15 g/mol. Its IUPAC name is 2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid.

Molecular Properties

Compound Name2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid
PubChem CID59117352
Molecular FormulaC7H10O7
Molecular Weight206.15 g/mol
Exact Mass206.04
IUPAC Name2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid
SMILESCC(O)C(=O)OCC(=O)OCC(=O)O
InChIInChI=1S/C7H10O7/c1-4(8)7(12)14-3-6(11)13-2-5(9)10/h4,8H,2-3H2,1H3,(H,9,10)
InChIKeyMTSWYZDLIKYZDW-UHFFFAOYSA-N
XLogP-1.46
TPSA110.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.15
LogP ≤ 5-1.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid?
The IUPAC name of 2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid (CID 59117352) is 2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid.
What is the SMILES notation for 2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid?
The canonical SMILES for 2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid is CC(O)C(=O)OCC(=O)OCC(=O)O.
What is the InChIKey of 2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid?
The InChIKey is MTSWYZDLIKYZDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O7/c1-4(8)7(12)14-3-6(11)13-2-5(9)10/h4,8H,2-3H2,1H3,(H,9,10).
What are the key properties of 2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid?
2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid has a molecular weight of 206.15 g/mol, XLogP of -1.46, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxypropanoyloxy)acetyl]oxyacetic acid is sourced from PubChem (CID 59117352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).