AG01AKW2

Name: 4-[(2,2-Dimethylpropyl)carbamoyl]benzoic acid
Brand: Angene Chemical
SKU: AG01AKW2

1304943-12-1 | 4-[(2,2-Dimethylpropyl)carbamoyl]benzoic acid

AG01AKW2

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CAS Number	1304943-12-1
Catalog Number	AG01AKW2
Chemical Name	4-[(2,2-Dimethylpropyl)carbamoyl]benzoic acid
IUPAC Name	4-(2,2-dimethylpropylcarbamoyl)benzoic acid
InChI	InChI=1S/C13H17NO3/c1-13(2,3)8-14-11(15)9-4-6-10(7-5-9)12(16)17/h4-7H,8H2,1-3H3,(H,14,15)(H,16,17)
InChI Key	SOIKFRVPSFTGTC-UHFFFAOYSA-N
MDL Number	MFCD13216856
Molecular Formula	C13H17NO3
Molecular Weight	235.2790
SMILES	CC(CNC(C1=CC=C(C(O)=O)C=C1)=O)(C)C
Synonyms	4-[(2,2-dimethylpropyl)carbamoyl]benzoic acid, 1304943-12-1, CHEMBL3452292, ZINC40495108, AKOS010412094, MCULE-2588205682, NE38250, EN300-85467, Z818138128,

Complexity	286
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	4
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

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