4-Oxo-4-(2-thienyl)butyric acid - CAS 4653-08-1

Catalog:	BB026150
Product Name:	4-Oxo-4-(2-thienyl)butyric acid
CAS:	4653-08-1
Synonyms:	4-oxo-4-thiophen-2-ylbutanoic acid

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	4-oxo-4-thiophen-2-ylbutanoic acid
Description:	4-Oxo-4-(2-thienyl)butyric acid (CAS# 4653-08-1) is a useful research chemical.
Molecular Weight:	184.21
Molecular Formula:	C8H8O3S
Canonical SMILES:	C1=CSC(=C1)C(=O)CCC(=O)O
InChI:	InChI=1S/C8H8O3S/c9-6(3-4-8(10)11)7-2-1-5-12-7/h1-2,5H,3-4H2,(H,10,11)
InChI Key:	ULJMYWHLMLRYSO-UHFFFAOYSA-N
Boiling Point:	400.5 °C at 760 mmHg
Density:	1.334 g/cm³
Solubility:	Insoluble in water
Appearance:	Beige crystalline powder
MDL:	MFCD00022502
LogP:	1.79560

Publication Number	Title	Priority Date
CN-109942473-A	A kind of method of catalyst-free synthesis lactam derivatives	20190516
CN-109942473-B	Method for synthesizing lactam derivative without catalyst	20190516
WO-2020228170-A1	Catalyst-free synthesis method for lactam derivative	20190516
WO-2019005563-A1	METHODS ASSOCIATED WITH THE ACTIVATION OF THE SIGNALING PATHWAY OF BONE MORPHOGENETIC PROTEINS	20170627
US-10131842-B2	Liquid crystal alignment agent, liquid crystal alignment film, and liquid crystal display element	20151201

PMID	Publication Date	Title	Journal
11712905	20011101	Antibodies directed to drug epitopes to investigate the structure of drug-protein photoadducts. Recognition of a common photobound substructure in tiaprofenic acid/ketoprofen cross-photoreactivity	Chemical research in toxicology

Related Products

Online Inquiry

Name:

* Phone:

* Service & Products of Interested:

Project Description:

* Quantity:

* Email:

* Verification Code:

Customer Support

If the product you need is not in our catalog, please contact us in time to submit your needs. You can help our website get better and better. Why not submit the request today?

Submit Requirement

Customer Centered

Global Delivery

Warehouses in multiple cities to ensure fast delivery

Quality Assurance

Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

Process Scale-up

Process scale-up from lab to industrial scale

Flexible Batch Size

Flexible batch size for diverse industrial demands

Related Functional Groups

Carbonyl Compounds

[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[87-88-7]
Chloranilic acid
[17746-05-3]
Undecanoyl chloride
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[927676-51-5]
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid

Thiophenes

[79485-96-4]
3-Bromo-2,4-dimethylthiophene
[934080-82-7]
5-[(3,4-Dimethylphenoxy)methyl]thiophene-2-carboxylic acid
[74556-81-3]
5-[(3-Chlorophenoxy)methyl]thiophene-2-carboxylic acid
[1263280-02-9]
Ethyl 4-fluorobenzo[b]thiophene-2-carboxylate
[179556-14-0]
Ethyl 5-(methylsulfonamido)-1H-indole-2-carboxylate
[438220-53-2]
Ethyl 2-amino-4-(3,4-dimethylphenyl)-5-methylthiophene-3-carboxylate

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	191
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	184.01941529
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	184.01941529
Rotatable Bond Count:	4
Topological Polar Surface Area:	82.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.7