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1183295-84-2 | Benzoic acid, 2-amino-4,6-dimethoxy-, ethyl ester
CAS No: 1183295-84-2 Catalog No: AG000IP1 MDL No:MFCD12159982
Product Description
Catalog Number:
AG000IP1
Chemical Name:
Benzoic acid, 2-amino-4,6-dimethoxy-, ethyl ester
CAS Number:
1183295-84-2
Molecular Formula:
C11H15NO4
Molecular Weight:
225.2411
MDL Number:
MFCD12159982
IUPAC Name:
ethyl 2-amino-4,6-dimethoxybenzoate
InChI:
InChI=1S/C11H15NO4/c1-4-16-11(13)10-8(12)5-7(14-2)6-9(10)15-3/h5-6H,4,12H2,1-3H3
InChI Key:
AUIQKMFLSLZUSB-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(N)cc(cc1OC)OC
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.1g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.244g/mol
Monoisotopic Mass:
225.1g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
70.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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