AG0053CP

Name: Methyl 4-carbaMothioylbenzoate
Brand: Angene Chemical
SKU: AG0053CP

80393-38-0 | Methyl 4-carbaMothioylbenzoate

AG0053CP

SDS

COA

Price

$0.00

WARNING This product is not for human or veterinary use.

Request For Quotation

CAS Number	80393-38-0
Catalog Number	AG0053CP(AGN-PC-008DE2)
Chemical Name	Methyl 4-carbaMothioylbenzoate
IUPAC Name	methyl 4-carbamothioylbenzoate
InChI	InChI=1S/C9H9NO2S/c1-12-9(11)7-4-2-6(3-5-7)8(10)13/h2-5H,1H3,(H2,10,13)
InChI Key	FWQVHCUKDCCJSJ-UHFFFAOYSA-N
MDL Number	MFCD09759040
Molecular Formula	C9H9NO2S
Molecular Weight	195.2383
SMILES	O=C(OC)C1=CC=C(C(N)=S)C=C1
Synonyms	Methyl 4-carbamothioylbenzoate, 80393-38-0, Benzoic acid, 4-(aminothioxomethyl)-, methyl ester, 4-Thiocarbamoylbenzoic acid methyl ester, 4-Thiocarbamoyl-benzoic acid methyl ester, 4-carbomethoxybenzothiamide, 4-carbomethoxybe-nzothiamide, methyl 4-thiocarbamoylbenzoate, AC1Q436D, SCHEMBL2304252, CHEMBL3817931, CTK3E5661, DTXSID80464707, FWQVHCUKDCCJSJ-UHFFFAOYSA-N, KS-000022SQ, methyl 4-(aminocarbothioyl)benzoate, methyl 4-(aminocarbonothioyl)benzoate, MFCD09759040, ZINC39320575, AKOS006238804, BA-0935, MCULE-2793176192, NE19388, AJ-99795, methyl 4-(aminocarbothioyl)benzenecarboxylate, EN300-59218, 4-[Amino(thiocarbonyl)]benzoic acid methyl ester, CID11401319,

Complexity	210
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	195.035g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	195.236g/mol
Monoisotopic Mass	195.035g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	84.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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