Home Halogens Propanedioic acid, 2-[[(4-chlorophenyl)amino]methylene]-, 1,3-diethyl ester

Propanedioic acid, 2-[[(4-chlorophenyl)amino]methylene]-, 1,3-diethyl ester

CAS No.:
19056-79-2
Catalog Number:
AG002EN7
Molecular Formula:
C14H16ClNO4
Molecular Weight:
297.7341
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$163
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Product Description
Catalog Number:
AG002EN7
Chemical Name:
Propanedioic acid, 2-[[(4-chlorophenyl)amino]methylene]-, 1,3-diethyl ester
CAS Number:
19056-79-2
Molecular Formula:
C14H16ClNO4
Molecular Weight:
297.7341
MDL Number:
MFCD00173340
IUPAC Name:
diethyl 2-[(4-chloroanilino)methylidene]propanedioate
InChI:
InChI=1S/C14H16ClNO4/c1-3-19-13(17)12(14(18)20-4-2)9-16-11-7-5-10(15)6-8-11/h5-9,16H,3-4H2,1-2H3
InChI Key:
KLGCWGTZXLANQG-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=CNc1ccc(cc1)Cl)C(=O)OCC
Properties
Complexity:
342  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.077g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
297.735g/mol
Monoisotopic Mass:
297.077g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties