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14814-06-3 | Benzoic acid, 4-amino-2-methoxy-, ethyl ester
CAS No: 14814-06-3 Catalog No: AG001FHV MDL No:MFCD12913503
Product Description
Catalog Number:
AG001FHV
Chemical Name:
Benzoic acid, 4-amino-2-methoxy-, ethyl ester
CAS Number:
14814-06-3
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
MDL Number:
MFCD12913503
IUPAC Name:
ethyl 4-amino-2-methoxybenzoate
InChI:
InChI=1S/C10H13NO3/c1-3-14-10(12)8-5-4-7(11)6-9(8)13-2/h4-6H,3,11H2,1-2H3
InChI Key:
CYXBQXFRXCNWCF-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(cc1OC)N
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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