AG00IET3

Name: 5-Bromomethyl-1-methyl-1H-pyrazole-3-carboxylic acid methyl ester
Brand: Angene Chemical
SKU: AG00IET3

878744-22-0 | 5-Bromomethyl-1-methyl-1H-pyrazole-3-carboxylic acid methyl ester

AG00IET3

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CAS Number	878744-22-0
Catalog Number	AG00IET3(AGN-PC-0HDKMW)
Chemical Name	5-Bromomethyl-1-methyl-1H-pyrazole-3-carboxylic acid methyl ester
IUPAC Name	methyl 5-(bromomethyl)-1-methylpyrazole-3-carboxylate
InChI	InChI=1S/C7H9BrN2O2/c1-10-5(4-8)3-6(9-10)7(11)12-2/h3H,4H2,1-2H3
InChI Key	XPUITOYPHIBAKN-UHFFFAOYSA-N
MDL Number	MFCD21362488
Molecular Formula	C7H9BrN2O2
Molecular Weight	233.0626
SMILES	COC(C1=NN(C)C(CBr)=C1)=O
Synonyms	878744-22-0, methyl 5-(bromomethyl)-1-methyl-1H-pyrazole-3-carboxylate, 5-Bromomethyl-1-methyl-1H-pyrazole-3-carboxylic acid methyl ester, SCHEMBL2249666, MFCD21362488, ZINC91695957, AKOS026743462, PS-9963, 1H-Pyrazole-3-carboxylic acid, 5-(bromomethyl)-1-methyl-, methyl ester,

Complexity	177
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	231.985g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	233.065g/mol
Monoisotopic Mass	231.985g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	44.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

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