Home Halogens 2-chloro-5-[(ethoxycarbonyl)amino]benzoic acid

2-chloro-5-[(ethoxycarbonyl)amino]benzoic acid

CAS No.:
847617-07-6
Catalog Number:
AG01EKAX
Molecular Formula:
C10H10ClNO4
Molecular Weight:
243.6437
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Product Description
Catalog Number:
AG01EKAX
Chemical Name:
2-chloro-5-[(ethoxycarbonyl)amino]benzoic acid
CAS Number:
847617-07-6
Molecular Formula:
C10H10ClNO4
Molecular Weight:
243.6437
MDL Number:
MFCD12165104
IUPAC Name:
2-chloro-5-(ethoxycarbonylamino)benzoic acid
InChI:
InChI=1S/C10H10ClNO4/c1-2-16-10(15)12-6-3-4-8(11)7(5-6)9(13)14/h3-5H,2H2,1H3,(H,12,15)(H,13,14)
InChI Key:
FVMQWZHBPOEBKK-UHFFFAOYSA-N
SMILES:
CCOC(=O)Nc1ccc(c(c1)C(=O)O)Cl
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.03g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
243.643g/mol
Monoisotopic Mass:
243.03g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties