AG00DARM

Name: 4-[(2-Isopropylphenyl)amino]-4-oxobutanoic acid
Brand: Angene Chemical
SKU: AG00DARM

448250-78-0 | 4-[(2-Isopropylphenyl)amino]-4-oxobutanoic acid

AG00DARM

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CAS Number	448250-78-0
Catalog Number	AG00DARM(AGN-PC-0WB3SU)
Chemical Name	4-[(2-Isopropylphenyl)amino]-4-oxobutanoic acid
IUPAC Name	4-oxo-4-(2-propan-2-ylanilino)butanoic acid
InChI	InChI=1S/C13H17NO3/c1-9(2)10-5-3-4-6-11(10)14-12(15)7-8-13(16)17/h3-6,9H,7-8H2,1-2H3,(H,14,15)(H,16,17)
InChI Key	JXJXZYKBWQRTIO-UHFFFAOYSA-N
MDL Number	MFCD01034361
Molecular Formula	C13H17NO3
Molecular Weight	235.2790
SMILES	C1(C=CC=CC=1C(C)C)NC(CCC(O)=O)=O
Synonyms	448250-78-0, 4-[(2-ISOPROPYLPHENYL)AMINO]-4-OXOBUTANOIC ACID, 4-((2-Isopropylphenyl)amino)-4-oxobutanoic acid, CHEMBRDG-BB 4024599, AC1NN5EK, Oprea1_337452, CTK4I8478, DTXSID20407936, ZINC5413891, MFCD01034361, STK259686, AKOS002287818, MCULE-8886188176, AJ-53984, ST50808629, 4-oxo-4-(2-propan-2-ylanilino)butanoic acid, W-7813, 4-Oxo-4-[2-(propan-2-yl)anilino]butanoic acid, 3-{N-[2-(methylethyl)phenyl]carbamoyl}propanoic acid, 4-oxo-4-{[2-(propan-2-yl)phenyl]amino}butanoic acid, CHEMBRDG-BB4024599, CID5062688, 3-[(2-propan-2-ylphenyl)carbamoyl]propanoic Acid,

Complexity	276
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	235.121g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	235.283g/mol
Monoisotopic Mass	235.121g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

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