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20983-84-0

20983-84-0 | 4-(Ethoxyoxalyl-amino)-benzoic acid propyl ester

CAS No: 20983-84-0 Catalog No: AG01F9MP MDL No:

Product Description

Catalog Number:
AG01F9MP
Chemical Name:
4-(Ethoxyoxalyl-amino)-benzoic acid propyl ester
CAS Number:
20983-84-0
Molecular Formula:
C14H17NO5
Molecular Weight:
279.2885
IUPAC Name:
propyl 4-[(5,6-dimethyl-2H-pyran-2-yl)-ethoxyamino]benzoate
InChI:
InChI=1S/C19H25NO4/c1-5-13-22-19(21)16-8-10-17(11-9-16)20(23-6-2)18-12-7-14(3)15(4)24-18/h7-12,18H,5-6,13H2,1-4H3
InChI Key:
MOMBLJRURDFOKF-UHFFFAOYSA-N
SMILES:
CCCOC(=O)c1ccc(cc1)NC(=O)C(=O)OCC

Properties

Complexity:
478  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.178g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.412g/mol
Monoisotopic Mass:
331.178g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
48A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  

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