AG019NAS

Name: 3-(Aminocarbonothioyl)benzoic acid
Brand: Angene Chemical
SKU: AG019NAS

35195-77-8 | 3-(Aminocarbonothioyl)benzoic acid

AG019NAS

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CAS Number	35195-77-8
Catalog Number	AG019NAS(AGN-PC-0NHM7Y)
Chemical Name	3-(Aminocarbonothioyl)benzoic acid
IUPAC Name	3-carbamothioylbenzoic acid
InChI	InChI=1S/C8H7NO2S/c9-7(12)5-2-1-3-6(4-5)8(10)11/h1-4H,(H2,9,12)(H,10,11)
InChI Key	YNHKKSMYDIEQKY-UHFFFAOYSA-N
MDL Number	MFCD11505522
Molecular Formula	C8H7NO2S
Molecular Weight	181.2117
SMILES	NC(C1=CC(C(O)=O)=CC=C1)=S
Synonyms	3-carbamothioylbenzoic acid, 3-(aminocarbonothioyl)benzoic acid, 35195-77-8, 3-thiocarbamoyl benzoic acid, AC1Q4ZYI, 3-Thiocarbamoylbenzoic acid, SCHEMBL1505260, CTK7I8598, YNHKKSMYDIEQKY-UHFFFAOYSA-N, STL449657, ZINC32627738, AKOS009395173, MCULE-2973781485, NE18364, AZ0001-0390, EN300-39847, 34612-EP2301536A1, 34612-EP2301538A1, 34612-EP2311455A1, Z415636536,

Complexity	205
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	1.6

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