AG00G31Q

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CAS Number	76003-76-4
Catalog Number	AG00G31Q(AGN-PC-0NJRFU)
Chemical Name	Methyl 1-benzyl-1H-1，2，3-triazole-4-carboxylate
IUPAC Name	methyl 1-benzyltriazole-4-carboxylate
InChI	InChI=1S/C11H11N3O2/c1-16-11(15)10-8-14(13-12-10)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3
InChI Key	HXGLNRKZOVMAQC-UHFFFAOYSA-N
MDL Number	MFCD03084464
Molecular Formula	C11H11N3O2
Molecular Weight	217.2239
SMILES	COC(C1N=NN(CC2=CC=CC=C2)C=1)=O
Synonyms	methyl 1-benzyl-1H-1,2,3-triazole-4-carboxylate, 76003-76-4, CHEMBL402277, SCHEMBL1719412, HXGLNRKZOVMAQC-UHFFFAOYSA-N, ZINC26544726, methyl 1-benzyltriazole-4-carboxylate, AKOS004115266, MCULE-1896137195, NE43565, Methyl 1-benzyl-1H-[1,2,3]triazol-4-carboxylate, F2157-0793, Z379686588, 1-Benzyl-1H-1,2,3-triazole-4-carboxylic acid methyl ester, 1-BENZYL-1H-[1,2,3]TRIAZOLE-4-CARBOXYLIC ACID,

Complexity	241
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.085g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	217.228g/mol
Monoisotopic Mass	217.085g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	57A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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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