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848950-33-4 | Benzoic acid, 4-(ethoxyamino)-, ethyl ester
CAS No: 848950-33-4 Catalog No: AG004QE2 MDL No:
Product Description
Catalog Number:
AG004QE2
Chemical Name:
Benzoic acid, 4-(ethoxyamino)-, ethyl ester
CAS Number:
848950-33-4
Molecular Formula:
C11H15NO3
Molecular Weight:
209.2417
IUPAC Name:
ethyl 4-(ethoxyamino)benzoate
InChI:
InChI=1S/C11H15NO3/c1-3-14-11(13)9-5-7-10(8-6-9)12-15-4-2/h5-8,12H,3-4H2,1-2H3
InChI Key:
LDNVMFVPCBXFFN-UHFFFAOYSA-N
SMILES:
CCONc1ccc(cc1)C(=O)OCC
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.105g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.245g/mol
Monoisotopic Mass:
209.105g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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