Home Amines 10268-69-6
10268-69-6,MFCD00060603
Catalog No.:AA00081M
10268-69-6 | Benzoic acid, 2-amino-, phenyl ester
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Technical Information
Catalog Number:
AA00081M
Chemical Name:
Benzoic acid, 2-amino-, phenyl ester
CAS Number:
10268-69-6
Molecular Formula:
C13H11NO2
Molecular Weight:
213.2319
MDL Number:
MFCD00060603
IUPAC Name:
phenyl 2-aminobenzoate
InChI:
InChI=1S/C13H11NO2/c14-12-9-5-4-8-11(12)13(15)16-10-6-2-1-3-7-10/h1-9H,14H2
InChI Key:
ZBFSYQBEXZGTAX-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1N)Oc1ccccc1
EC Number:
233-608-1
Properties
Computed Properties
 
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.079g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.236g/mol
Monoisotopic Mass:
213.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

Synonyms
 
Phenyl anthranilate 
Phenyl 2-aminobenzoate 
SCHEMBL444509 
AC1L252F 
AC1Q529E 
CTK4A1388 
DTXSID50145450 
ZBFSYQBEXZGTAX-UHFFFAOYSA-N 
Benzoic acid,2-amino-,phenyl ester 
ZINC2015863 
7674AC 
Benzoic acid, 2-amino-,phenyl ester 
10268-69-6 
MFCD00060603 
AKOS015838924 
CJ-31294 
TR-000643 
FT-0682120 
C-44897 
I14-27008 
C13H11NO2 
CID66300 
C13-H11-N-O2 
Benzoic acid, 2-amino-, phenyl ester 
2-Aminobenzoic acid phenyl ester 
phenylanthranilate 
EINECS 233-608-1 
Phenyl o-aminobenzoate 
AI3-36600 
Phenyl 2-aminobenzoate # 
Literature

Title: Characterization of a selective inhibitor of the Parkinson's disease kinase LRRK2.

Journal: Nature chemical biology 20110401

Title: New noncovalent inhibitors of penicillin-binding proteins from penicillin-resistant bacteria.

Journal: PloS one 20110101

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