AG00CXZJ

Name: methyl 4-cyano-1-methyl-1H-pyrrole-2-carboxylate
Brand: Angene Chemical
SKU: AG00CXZJ

40740-43-0 | methyl 4-cyano-1-methyl-1H-pyrrole-2-carboxylate

AG00CXZJ

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CAS Number	40740-43-0
Catalog Number	AG00CXZJ
Chemical Name	methyl 4-cyano-1-methyl-1H-pyrrole-2-carboxylate
IUPAC Name	methyl 4-cyano-1-methylpyrrole-2-carboxylate
InChI	InChI=1S/C8H8N2O2/c1-10-5-6(4-9)3-7(10)8(11)12-2/h3,5H,1-2H3
InChI Key	HQBXXDPQBFVNEF-UHFFFAOYSA-N
MDL Number	MFCD13178586
Molecular Formula	C8H8N2O2
Molecular Weight	164.1613
SMILES	COC(C1N(C)C=C(C#N)C=1)=O
Synonyms	40740-43-0, Methyl 4-cyano-1-methyl-1H-pyrrole-2-carboxylate, 4-cyano-1-methyl-pyrrole-2-carboxylic acid methyl ester, ZINC39058427, AKOS022060288, Z1363855262, 1H-Pyrrole-2-carboxylicacid,4-cyano-1-methyl-,methylester(9CI), 1H-Pyrrole-2-carboxylic acid, 4-cyano-1-methyl-, methyl ester (9CI),

Complexity	231
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.059g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	164.164g/mol
Monoisotopic Mass	164.059g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

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