(2R)-2-hydroxy-3-phenylmethoxypropanoic acid

C10H12O4 — CID 14810077

IUPAC(2R)-2-hydroxy-3-phenylmethoxypropanoic acid
SMILESO=C(O)[C@H](O)COCc1ccccc1
InChIInChI=1S/C10H12O4/c11-9(10(12)13)7-14-6-8-4-2-1-3-5-8/h1-5,9,11H,6-7H2,(H,12,13)/t9-/m1/s1
InChIKeyLYSUHDDCSREYHC-SECBINFHSA-N
MW196.20 g/mol
LogP0.65
Rot. Bonds5

About (2R)-2-hydroxy-3-phenylmethoxypropanoic acid

(2R)-2-hydroxy-3-phenylmethoxypropanoic acid (PubChem CID 14810077) has the molecular formula C10H12O4 and a molecular weight of 196.20 g/mol. Its IUPAC name is (2R)-2-hydroxy-3-phenylmethoxypropanoic acid.

Molecular Properties

Compound Name(2R)-2-hydroxy-3-phenylmethoxypropanoic acid
PubChem CID14810077
Molecular FormulaC10H12O4
Molecular Weight196.20 g/mol
Exact Mass196.07
IUPAC Name(2R)-2-hydroxy-3-phenylmethoxypropanoic acid
SMILESO=C(O)[C@H](O)COCc1ccccc1
InChIInChI=1S/C10H12O4/c11-9(10(12)13)7-14-6-8-4-2-1-3-5-8/h1-5,9,11H,6-7H2,(H,12,13)/t9-/m1/s1
InChIKeyLYSUHDDCSREYHC-SECBINFHSA-N
XLogP0.65
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.20
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-hydroxy-3-phenylmethoxypropanoic acid?
The IUPAC name of (2R)-2-hydroxy-3-phenylmethoxypropanoic acid (CID 14810077) is (2R)-2-hydroxy-3-phenylmethoxypropanoic acid.
What is the SMILES notation for (2R)-2-hydroxy-3-phenylmethoxypropanoic acid?
The canonical SMILES for (2R)-2-hydroxy-3-phenylmethoxypropanoic acid is O=C(O)[C@H](O)COCc1ccccc1.
What is the InChIKey of (2R)-2-hydroxy-3-phenylmethoxypropanoic acid?
The InChIKey is LYSUHDDCSREYHC-SECBINFHSA-N. The full InChI is InChI=1S/C10H12O4/c11-9(10(12)13)7-14-6-8-4-2-1-3-5-8/h1-5,9,11H,6-7H2,(H,12,13)/t9-/m1/s1.
What are the key properties of (2R)-2-hydroxy-3-phenylmethoxypropanoic acid?
(2R)-2-hydroxy-3-phenylmethoxypropanoic acid has a molecular weight of 196.20 g/mol, XLogP of 0.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-hydroxy-3-phenylmethoxypropanoic acid is sourced from PubChem (CID 14810077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).