Home Halogens Dimethyl 2-[(chloroacetyl)amino]terephthalate

Dimethyl 2-[(chloroacetyl)amino]terephthalate

CAS No.:
325763-68-6
Catalog Number:
AG00BZ4E
Molecular Formula:
C12H12ClNO5
Molecular Weight:
285.6804
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$129
- +
5g
95%
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG00BZ4E
Chemical Name:
Dimethyl 2-[(chloroacetyl)amino]terephthalate
CAS Number:
325763-68-6
Molecular Formula:
C12H12ClNO5
Molecular Weight:
285.6804
MDL Number:
MFCD02342053
IUPAC Name:
dimethyl 2-[(2-chloroacetyl)amino]benzene-1,4-dicarboxylate
InChI:
InChI=1S/C12H12ClNO5/c1-18-11(16)7-3-4-8(12(17)19-2)9(5-7)14-10(15)6-13/h3-5H,6H2,1-2H3,(H,14,15)
InChI Key:
MCJXWDAWSRTYBH-UHFFFAOYSA-N
SMILES:
ClCC(=O)Nc1cc(ccc1C(=O)OC)C(=O)OC
Properties
Complexity:
360  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.04g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
285.68g/mol
Monoisotopic Mass:
285.04g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
81.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties