(2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid

C8H8O4 — CID 13358352

IUPAC(2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid
SMILESO=C(O)[C@H](O)c1cccc(O)c1
InChIInChI=1S/C8H8O4/c9-6-3-1-2-5(4-6)7(10)8(11)12/h1-4,7,9-10H,(H,11,12)/t7-/m1/s1
InChIKeyOLSDAJRAVOVKLG-SSDOTTSWSA-N
MW168.15 g/mol
LogP0.51
Rot. Bonds2

About (2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid

(2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid (PubChem CID 13358352) has the molecular formula C8H8O4 and a molecular weight of 168.15 g/mol. Its IUPAC name is (2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid.

Molecular Properties

Compound Name(2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid
PubChem CID13358352
Molecular FormulaC8H8O4
Molecular Weight168.15 g/mol
Exact Mass168.04
IUPAC Name(2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid
SMILESO=C(O)[C@H](O)c1cccc(O)c1
InChIInChI=1S/C8H8O4/c9-6-3-1-2-5(4-6)7(10)8(11)12/h1-4,7,9-10H,(H,11,12)/t7-/m1/s1
InChIKeyOLSDAJRAVOVKLG-SSDOTTSWSA-N
XLogP0.51
TPSA77.76 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.15
LogP ≤ 50.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid?
The IUPAC name of (2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid (CID 13358352) is (2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid.
What is the SMILES notation for (2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid?
The canonical SMILES for (2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid is O=C(O)[C@H](O)c1cccc(O)c1.
What is the InChIKey of (2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid?
The InChIKey is OLSDAJRAVOVKLG-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H8O4/c9-6-3-1-2-5(4-6)7(10)8(11)12/h1-4,7,9-10H,(H,11,12)/t7-/m1/s1.
What are the key properties of (2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid?
(2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid has a molecular weight of 168.15 g/mol, XLogP of 0.51, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-hydroxy-2-(3-hydroxyphenyl)acetic acid is sourced from PubChem (CID 13358352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).