AG00J541

Name: 4-formyl-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
Brand: Angene Chemical
SKU: AG00J541

861582-93-6 | 4-formyl-2,5-dimethyl-1H-pyrrole-3-carboxylic acid

AG00J541

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COA

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CAS Number	861582-93-6
Catalog Number	AG00J541(AGN-PC-0WC9PF)
Chemical Name	4-formyl-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
IUPAC Name	4-formyl-2,5-dimethyl-1H-pyrrole-3-carboxylic acid
InChI	InChI=1S/C8H9NO3/c1-4-6(3-10)7(8(11)12)5(2)9-4/h3,9H,1-2H3,(H,11,12)
InChI Key	HIHMHNSVINECDT-UHFFFAOYSA-N
MDL Number	MFCD14281689
Molecular Formula	C8H9NO3
Molecular Weight	167.1620
SMILES	CC1=C(C=O)C(C(O)=O)=C(C)N1
Synonyms	4-formyl-2,5-dimethyl-1H-pyrrole-3-carboxylic Acid, 861582-93-6, AC1MU0P2, ALBB-019486, ZINC5137955, MFCD14281689, AKOS001848122, MCULE-9500403850, 1H-pyrrole-3-carboxylic acid, 4-formyl-2,5-dimethyl-, CID3633483,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	167.058g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	167.164g/mol
Monoisotopic Mass	167.058g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	70.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

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