(2R)-4-(furan-2-yl)-2-hydroxybutanoic acid

C8H10O4 — CID 141032870

IUPAC(2R)-4-(furan-2-yl)-2-hydroxybutanoic acid
SMILESO=C(O)[C@H](O)CCc1ccco1
InChIInChI=1S/C8H10O4/c9-7(8(10)11)4-3-6-2-1-5-12-6/h1-2,5,7,9H,3-4H2,(H,10,11)/t7-/m1/s1
InChIKeyKPGZCSKUQGXPOY-SSDOTTSWSA-N
MW170.16 g/mol
LogP0.66
Rot. Bonds4

About (2R)-4-(furan-2-yl)-2-hydroxybutanoic acid

(2R)-4-(furan-2-yl)-2-hydroxybutanoic acid (PubChem CID 141032870) has the molecular formula C8H10O4 and a molecular weight of 170.16 g/mol. Its IUPAC name is (2R)-4-(furan-2-yl)-2-hydroxybutanoic acid.

Molecular Properties

Compound Name(2R)-4-(furan-2-yl)-2-hydroxybutanoic acid
PubChem CID141032870
Molecular FormulaC8H10O4
Molecular Weight170.16 g/mol
Exact Mass170.06
IUPAC Name(2R)-4-(furan-2-yl)-2-hydroxybutanoic acid
SMILESO=C(O)[C@H](O)CCc1ccco1
InChIInChI=1S/C8H10O4/c9-7(8(10)11)4-3-6-2-1-5-12-6/h1-2,5,7,9H,3-4H2,(H,10,11)/t7-/m1/s1
InChIKeyKPGZCSKUQGXPOY-SSDOTTSWSA-N
XLogP0.66
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.16
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(furan-2-yl)-2-methylpentanoic acid
CID 82075109
2-[4-(furan-2-yl)butan-2-ylamino]butanoic acid
CID 64669169
2-[4-(furan-2-yl)butan-2-ylcarbamoyl-methylamino]propanoic acid
CID 55096590
1-(furan-2-yl)-6-methylheptan-3-ol
CID 105085501
2-amino-3-[4-(furan-2-yl)butan-2-ylamino]benzoic acid
CID 115545393
3-[2-(furan-2-yl)ethylamino]-2-methyl-3-oxopropanoic acid
CID 114897735
1-(furan-2-yl)hept-6-yn-3-ol
CID 105098567
(2R)-2-[4-(furan-2-yl)butan-2-ylcarbamoylamino]-3,3-dimethylbutanoic acid
CID 103927814
(Z)-4-[4-(furan-2-yl)butan-2-ylamino]-2,3-dimethyl-4-oxobut-2-enoic acid
CID 55169449
N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide
CID 61249906
N-[(2R)-4-(furan-2-yl)butan-2-yl]-3-methylbutanamide
CID 94153264
N-[4-(furan-2-yl)butan-2-yl]-3-oxobutanamide
CID 61251024

Frequently Asked Questions

What is the IUPAC name of (2R)-4-(furan-2-yl)-2-hydroxybutanoic acid?
The IUPAC name of (2R)-4-(furan-2-yl)-2-hydroxybutanoic acid (CID 141032870) is (2R)-4-(furan-2-yl)-2-hydroxybutanoic acid.
What is the SMILES notation for (2R)-4-(furan-2-yl)-2-hydroxybutanoic acid?
The canonical SMILES for (2R)-4-(furan-2-yl)-2-hydroxybutanoic acid is O=C(O)[C@H](O)CCc1ccco1.
What is the InChIKey of (2R)-4-(furan-2-yl)-2-hydroxybutanoic acid?
The InChIKey is KPGZCSKUQGXPOY-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H10O4/c9-7(8(10)11)4-3-6-2-1-5-12-6/h1-2,5,7,9H,3-4H2,(H,10,11)/t7-/m1/s1.
What are the key properties of (2R)-4-(furan-2-yl)-2-hydroxybutanoic acid?
(2R)-4-(furan-2-yl)-2-hydroxybutanoic acid has a molecular weight of 170.16 g/mol, XLogP of 0.66, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(furan-2-yl)-2-hydroxybutanoic acid is sourced from PubChem (CID 141032870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).