(2R)-2-thiophen-2-ylpropanoic acid

C7H8O2S — CID 10942705

IUPAC(2R)-2-thiophen-2-ylpropanoic acid
SMILESC[C@H](C(=O)O)c1cccs1
InChIInChI=1S/C7H8O2S/c1-5(7(8)9)6-3-2-4-10-6/h2-5H,1H3,(H,8,9)/t5-/m0/s1
InChIKeyKTKWUKAYWFMQSO-YFKPBYRVSA-N
MW156.21 g/mol
LogP1.94
Rot. Bonds2

About (2R)-2-thiophen-2-ylpropanoic acid

(2R)-2-thiophen-2-ylpropanoic acid (PubChem CID 10942705) has the molecular formula C7H8O2S and a molecular weight of 156.21 g/mol. Its IUPAC name is (2R)-2-thiophen-2-ylpropanoic acid.

Molecular Properties

Compound Name(2R)-2-thiophen-2-ylpropanoic acid
PubChem CID10942705
Molecular FormulaC7H8O2S
Molecular Weight156.21 g/mol
Exact Mass156.02
IUPAC Name(2R)-2-thiophen-2-ylpropanoic acid
SMILESC[C@H](C(=O)O)c1cccs1
InChIInChI=1S/C7H8O2S/c1-5(7(8)9)6-3-2-4-10-6/h2-5H,1H3,(H,8,9)/t5-/m0/s1
InChIKeyKTKWUKAYWFMQSO-YFKPBYRVSA-N
XLogP1.94
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.21
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Thiopheneacetic acid
CID 15970
4-(2-Thienyl)Butyric Acid
CID 78386
2-(Thiophen-2-ylmethyl)propanedioic acid
CID 236591
5-(2-Thienyl)valeric acid
CID 152324
Methyl thiophen-2-acetate
CID 88055
Ethyl 2-thienylacetate
CID 93657
3-(2-Thienyl)propanoic acid
CID 703169
Di(2-thienyl)acetic acid
CID 20443
3-(Thiophen-3-yl)propanoic acid
CID 268918
1-(Thiophen-2-yl)cyclohexane-1-carboxylic acid
CID 820724
4-Ethylthiophene-2-carboxylic acid
CID 18938079
1-(Thiophen-2-yl)cyclopentane-1-carboxylic acid
CID 23294886

Frequently Asked Questions

What is the IUPAC name of (2R)-2-thiophen-2-ylpropanoic acid?
The IUPAC name of (2R)-2-thiophen-2-ylpropanoic acid (CID 10942705) is (2R)-2-thiophen-2-ylpropanoic acid.
What is the SMILES notation for (2R)-2-thiophen-2-ylpropanoic acid?
The canonical SMILES for (2R)-2-thiophen-2-ylpropanoic acid is C[C@H](C(=O)O)c1cccs1.
What is the InChIKey of (2R)-2-thiophen-2-ylpropanoic acid?
The InChIKey is KTKWUKAYWFMQSO-YFKPBYRVSA-N. The full InChI is InChI=1S/C7H8O2S/c1-5(7(8)9)6-3-2-4-10-6/h2-5H,1H3,(H,8,9)/t5-/m0/s1.
What are the key properties of (2R)-2-thiophen-2-ylpropanoic acid?
(2R)-2-thiophen-2-ylpropanoic acid has a molecular weight of 156.21 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-thiophen-2-ylpropanoic acid is sourced from PubChem (CID 10942705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).