AG006YSP

Name: Isothiazole-3-carboxylic acid
Brand: Angene Chemical
SKU: AG006YSP

4576-90-3 | Isothiazole-3-carboxylic acid

AG006YSP

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COA

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CAS Number	4576-90-3
Catalog Number	AG006YSP(AGN-PC-0JSVPH)
Chemical Name	Isothiazole-3-carboxylic acid
IUPAC Name	1,2-thiazole-3-carboxylic acid
InChI	InChI=1S/C4H3NO2S/c6-4(7)3-1-2-8-5-3/h1-2H,(H,6,7)
InChI Key	BMPVWNJQCJQBFW-UHFFFAOYSA-N
MDL Number	MFCD09834765
Molecular Formula	C4H3NO2S
Molecular Weight	129.1371
SMILES	OC(=O)C1=NSC=C1
Synonyms	Isothiazole-3-carboxylic acid, 4576-90-3, 3-Isothiazolecarboxylic acid, 1,2-thiazole-3-carboxylic acid, BMPVWNJQCJQBFW-UHFFFAOYSA-N, MFCD09834765, isothiazolecarboxylic acid, 3-Isothiazolecarboxylicacid, isothiazolecarboxylic, 3-Carboxyisothiazole, AC1LBJVZ, PubChem22100, AC1Q5UHD, isothiazol-3-carboxylic acid, SCHEMBL675975, CTK1D5588, DTXSID00339862, KS-00000GG9, 6302AB, ANW-74235, ZINC12958089, AKOS006283195, PB34433, QC-1139, RP08197, AJ-63311, AK-77227, DS-17016, SC-82581, AB0004269, DB-070680, TC-162980, 4CH-005252, AM20100170, BB 0261030, CS-0054866, FT-0686042, ST24047457, C-2045, 576I903, J-521604, I14-15096, Z1198233153, C4H3NO2S, AR-1J2840, CID559224, ACN-044587, isothiazole-3-carboxylic acid, 95% - 1G 1g,

Complexity	106
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	128.988g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	129.133g/mol
Monoisotopic Mass	128.988g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	78.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited