AG0090EP

Name: 3-(3-Methylthioureido)phenylboronic acid
Brand: Angene Chemical
SKU: AG0090EP

1072946-17-8 | 3-(3-Methylthioureido)phenylboronic acid

AG0090EP

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CAS Number	1072946-17-8
Catalog Number	AG0090EP(AGN-PC-0WA7BP)
Chemical Name	3-(3-Methylthioureido)phenylboronic acid
IUPAC Name	[3-(methylcarbamothioylamino)phenyl]boronic acid
InChI	InChI=1S/C8H11BN2O2S/c1-10-8(14)11-7-4-2-3-6(5-7)9(12)13/h2-5,12-13H,1H3,(H2,10,11,14)
InChI Key	BRXUVOXFWKMDPA-UHFFFAOYSA-N
MDL Number	MFCD09972118
Molecular Formula	C8H11BN2O2S
Molecular Weight	210.0611
SMILES	CNC(=S)Nc1cccc(c1)B(O)O
Synonyms	3-(3-Methylthioureido)phenylboronic acid, 1072946-17-8, ACMC-2098rj, SCHEMBL2554968, CTK4A5236, DTXSID70674414, ANW-15629, AKOS015850876, ZINC169903844, FCH1396721, RTR-001561, OR361493, TR-001561, Z7037, {3-[(Methylcarbamothioyl)amino]phenyl}boronic acid, I04-2627, C8H11BN2O2S, A-4550,

Complexity	204
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	210.063g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	210.058g/mol
Monoisotopic Mass	210.063g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	96.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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