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CAS Number: 111714-47-7
methyl 3-acetyl-4-aminobenzoate

Structure

methyl 3-acetyl-4-aminobenzoate
Name: methyl 3-acetyl-4-aminobenzoate
Synonyms:
General Information
Product Number: 111714477
CAS Registry Number: 111714-47-7
Name:
        Benzoic acid, 3-​acetyl-​4-​amino-​, methyl ester
        3-​Acetyl-​4-​aminobenzoic acid methyl ester; Methyl 3-​acetyl-​4-​aminobenzoate 
 
Chemical Formula: C10H11NO3
Exact Mass: 193.07
Molecular Weight: 193.20
m/z: 193.07 (100.0%), 194.08 (11.1%), 195.08 (1.2%)
Elemental Analysis: C, 62.17; H, 5.74; N, 7.25; O, 24.84
 
InChI: InChI=1S/C10H11NO3/c1-6(12)8-5-7(10(13)14-2)3-4-9(8)11/h3-5H,11H2,1-2H3
InChIKey: UWOWQJXAUBYDTF-UHFFFAOYSA-N
Canonical SMILES : CC(=O)C1=C(C=CC(=C1)C(=O)OC)N

Specification

98%

References

PCT Int. Appl. (2009), WO 2009054468 A1 20090430.                                 

PCT Int. Appl. (2007), WO 2007144379 A1 20071221.

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