isothiazole-5-carboxylic acid - CAS 10271-85-9

Name: isothiazole-5-carboxylic acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB000928
Product Name:	isothiazole-5-carboxylic acid
CAS:	10271-85-9
Synonyms:	5-isothiazolecarboxylic acid; 1,2-thiazole-5-carboxylic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1,2-thiazole-5-carboxylic acid
Description:	isothiazole-5-carboxylic acid (CAS# 10271-85-9) is a useful research chemical.
Molecular Weight:	129.14
Molecular Formula:	C4H3NO2S
Canonical SMILES:	C1=C(SN=C1)C(=O)O
InChI:	InChI=1S/C4H3NO2S/c6-4(7)3-1-2-5-8-3/h1-2H,(H,6,7)
InChI Key:	GGYXPOOZYZHPLB-UHFFFAOYSA-N
Boiling Point:	178.4 °C at 760 mmHg
Density:	1.525 g/cm³
Appearance:	White to yellow solid
LogP:	0.84130

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

[55441-25-3]C8H7N3O
1-(2-Cyanophenyl)urea
[832741-29-4]C9H11BrOS
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[91552-11-3]C10H9ClO2
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid
[957292-12-5]C8H10N2O2
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid
[2168559-63-3]C8H10ClNO2
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride
[927676-51-5]C10H6BrNO3
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid

GHS Hazard Statement:	H302 (25%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021173930-A1	Kcnt1 inhibitors and methods of use	20200228
WO-2021154902-A1	Collagen 1 translation inhibitors and methods of use thereof	20200130
WO-2021055612-A1	Substituted imidazole carboxamides and their use in the treatment of medical disorders	20190917
CN-111848461-A	NLRP3 inflammasome inhibitor and preparation method and application thereof	20190429
WO-2020085234-A1	Morphinan derivative	20181022

Complexity:	106
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	128.98844951
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	128.98844951
Rotatable Bond Count:	1
Topological Polar Surface Area:	78.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8