AG00IR1J

Name: Ethyl 5-(3-nitrophenyl)-1H-pyrazole-3-carboxylate
Brand: Angene Chemical
SKU: AG00IR1J

1025724-57-5 | Ethyl 5-(3-nitrophenyl)-1H-pyrazole-3-carboxylate

AG00IR1J

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CAS Number	1025724-57-5
Catalog Number	AG00IR1J(AGN-PC-0WAUWM)
Chemical Name	Ethyl 5-(3-nitrophenyl)-1H-pyrazole-3-carboxylate
IUPAC Name	ethyl 3-(3-nitrophenyl)-1H-pyrazole-5-carboxylate
InChI	InChI=1S/C12H11N3O4/c1-2-19-12(16)11-7-10(13-14-11)8-4-3-5-9(6-8)15(17)18/h3-7H,2H2,1H3,(H,13,14)
InChI Key	VIKHZBXGLAOVFS-UHFFFAOYSA-N
MDL Number	MFCD00245769
Molecular Formula	C12H11N3O4
Molecular Weight	261.2334
SMILES	O=[N+]([O-])C2(=CC(C=1(NN=C(C=1)C(=O)OCC))=CC=C2)
Synonyms	ethyl 5-(3-nitrophenyl)-1H-pyrazole-3-carboxylate, 1025724-57-5, AC1LS19Q, MLS000763853, CHEMBL1380660, KS-00001NFF, HMS2709J16, MFCD03787571, STK359205, ZINC15986941, AKOS003397726, MCULE-1772984782, SMR000336479, 5W-0812, 941N968, ethyl 3-(3-nitrophenyl)-1H-pyrazole-5-carboxylate, 5-(3-Nitro-phenyl)-1H-pyrazole-3-carboxylic acid ethyl ester, ZINC01393761, CID1480766,

Complexity	344
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	261.075g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	261.237g/mol
Monoisotopic Mass	261.075g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	101A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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