AG00F4Y2

Name: 3-Methyl-2-(1H-pyrrol-1-yl)butanoic acid
Brand: Angene Chemical
SKU: AG00F4Y2

61429-10-5 | 3-Methyl-2-(1H-pyrrol-1-yl)butanoic acid

AG00F4Y2

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COA

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CAS Number	61429-10-5
Catalog Number	AG00F4Y2(AGN-PC-0T0F4Q)
Chemical Name	3-Methyl-2-(1H-pyrrol-1-yl)butanoic acid
IUPAC Name	3-methyl-2-pyrrol-1-ylbutanoic acid
InChI	InChI=1S/C9H13NO2/c1-7(2)8(9(11)12)10-5-3-4-6-10/h3-8H,1-2H3,(H,11,12)
InChI Key	HAWLRFHCZBAAQG-UHFFFAOYSA-N
MDL Number	MFCD08083040
Molecular Formula	C9H13NO2
Molecular Weight	167.2050
SMILES	CC(C(N1C=CC=C1)C(O)=O)C
Synonyms	3-methyl-2-(1H-pyrrol-1-yl)butanoic acid, 61429-10-5, (2S)-3-Methyl-2-(1H-pyrrol-1-yl)butanoic acid, 3-methyl-2-pyrrolylbutanoic acid, 63813-68-3, ARONIS011589, SCHEMBL18258607, CTK6A4115, 6702AE, BBL037016, SBB080009, STL066485, 3-Methyl-2-pyrrol-1-yl-butyric acid, AKOS000140090, AKOS016050318, 2-(1-Pyrrolyl)-3-methylbutanoic acid, MCULE-5836980565, 3-methyl-2-(pyrrol-1-yl)butanoic acid, KS-000042P0, 1-(2'-methyl-1'-carboxy-propyl) pyrrole, TR-048151, ST45048307, F3310-0229, C9H13NO2, N/A,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	167.095g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	167.208g/mol
Monoisotopic Mass	167.095g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	42.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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