Home Halogens Ethyl 3-[(chloroacetyl)amino]benzoate

Ethyl 3-[(chloroacetyl)amino]benzoate

CAS No.:
58915-19-8
Catalog Number:
AG00EA84
Molecular Formula:
C11H12ClNO3
Molecular Weight:
241.6709
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
Product Description
Catalog Number:
AG00EA84
Chemical Name:
Ethyl 3-[(chloroacetyl)amino]benzoate
CAS Number:
58915-19-8
Molecular Formula:
C11H12ClNO3
Molecular Weight:
241.6709
MDL Number:
MFCD00711338
IUPAC Name:
ethyl 3-[(2-chloroacetyl)amino]benzoate
InChI:
InChI=1S/C11H12ClNO3/c1-2-16-11(15)8-4-3-5-9(6-8)13-10(14)7-12/h3-6H,2,7H2,1H3,(H,13,14)
InChI Key:
GWRKWJKNWBWCPD-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cccc(c1)NC(=O)CCl
NSC Number:
708443
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.671g/mol
Monoisotopic Mass:
241.051g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Microtubule target for new antileishmanial drugs based on ethyl 3-haloacetamidobenzoates. Journal of enzyme inhibition and medicinal chemistry 20060601
Properties