AG00DN1V

Name: 4-(AMINOCARBONOTHIOYL)BENZOIC ACID
Brand: Angene Chemical
SKU: AG00DN1V

4989-36-0 | 4-(AMINOCARBONOTHIOYL)BENZOIC ACID

AG00DN1V

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COA

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WARNING This product is not for human or veterinary use.

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CAS Number	4989-36-0
Catalog Number	AG00DN1V(AGN-PC-015SVR)
Chemical Name	4-(AMINOCARBONOTHIOYL)BENZOIC ACID
IUPAC Name	4-carbamothioylbenzoic acid
InChI	InChI=1S/C8H7NO2S/c9-7(12)5-1-3-6(4-2-5)8(10)11/h1-4H,(H2,9,12)(H,10,11)
InChI Key	GVEVKAIAOIRIAL-UHFFFAOYSA-N
MDL Number	MFCD09044819
Molecular Formula	C8H7NO2S
Molecular Weight	181.2117
SMILES	C(=S)(N)c1ccc(cc1)C(=O)O
Synonyms	4-(aminocarbonothioyl)benzoic acid, 4989-36-0, 4-carbamothioylbenzoic acid, 4-thiocarbamoylbenzoic acid, AC1Q4ZYZ, 4-(thiocarbamoyl)benzoic acid, 4-(thiocarbamoyl) benzoic acid, SCHEMBL1972179, CHEMBL3596572, CTK4J1799, DTXSID60588213, GVEVKAIAOIRIAL-UHFFFAOYSA-N, ZINC12505765, AKOS000129066, MCULE-1300867261, NE14163, FT-0701813, EN300-28564, 4- BENZOICACID,

Complexity	197
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.02g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	181.209g/mol
Monoisotopic Mass	181.02g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	95.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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