AG01BOGE

Name: 5-tert-Butyl-2-methyl-1H-pyrrole-3-carboxylic acid
Brand: Angene Chemical
SKU: AG01BOGE

1269005-80-2 | 5-tert-Butyl-2-methyl-1H-pyrrole-3-carboxylic acid

AG01BOGE

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CAS Number	1269005-80-2
Catalog Number	AG01BOGE
Chemical Name	5-tert-Butyl-2-methyl-1H-pyrrole-3-carboxylic acid
IUPAC Name	5-tert-butyl-2-methyl-1H-pyrrole-3-carboxylic acid
InChI	InChI=1S/C10H15NO2/c1-6-7(9(12)13)5-8(11-6)10(2,3)4/h5,11H,1-4H3,(H,12,13)
InChI Key	BZBWSWSZEONYDO-UHFFFAOYSA-N
MDL Number	MFCD20660735
Molecular Formula	C10H15NO2
Molecular Weight	181.2316
SMILES	CC1=C(C(O)=O)C=C(C(C)(C)C)N1
Synonyms	1269005-80-2, SCHEMBL16418933, ZINC82395932, AKOS022706404, 5-tert-butyl-2-methyl-1-pyrrole-3-carboxylic acid, 5-tert-Butyl-2-methyl-1H-pyrrole-3-carboxylic acid,

Complexity	208
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.11g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	181.235g/mol
Monoisotopic Mass	181.11g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	53.1A^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