2-hydroxypropanoic acid

C3H6O3 — CID 612

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IUPAC2-hydroxypropanoic acid
SMILESCC(O)C(=O)O
InChIInChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)
InChIKeyJVTAAEKCZFNVCJ-UHFFFAOYSA-N
MW90.08 g/mol
LogP-0.55
Rot. Bonds1

About 2-hydroxypropanoic acid

2-hydroxypropanoic acid (PubChem CID 612) has the molecular formula C3H6O3 and a molecular weight of 90.08 g/mol. Its IUPAC name is 2-hydroxypropanoic acid.

Molecular Properties

Compound Name2-hydroxypropanoic acid
PubChem CID612
Molecular FormulaC3H6O3
Molecular Weight90.08 g/mol
Exact Mass90.03
IUPAC Name2-hydroxypropanoic acid
SMILESCC(O)C(=O)O
InChIInChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)
InChIKeyJVTAAEKCZFNVCJ-UHFFFAOYSA-N
XLogP-0.55
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50090.08
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxypropanoic acid?
The IUPAC name of 2-hydroxypropanoic acid (CID 612) is 2-hydroxypropanoic acid.
What is the SMILES notation for 2-hydroxypropanoic acid?
The canonical SMILES for 2-hydroxypropanoic acid is CC(O)C(=O)O.
What is the InChIKey of 2-hydroxypropanoic acid?
The InChIKey is JVTAAEKCZFNVCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6).
What are the key properties of 2-hydroxypropanoic acid?
2-hydroxypropanoic acid has a molecular weight of 90.08 g/mol, XLogP of -0.55, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxypropanoic acid is sourced from PubChem (CID 612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).