Home Halogens 5-(carbamoylamino)-2-chlorobenzoic acid

5-(carbamoylamino)-2-chlorobenzoic acid

CAS No.:
1183985-90-1
Catalog Number:
AG01DT82
Molecular Formula:
C8H7ClN2O3
Molecular Weight:
214.6058
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Product Description
Catalog Number:
AG01DT82
Chemical Name:
5-(carbamoylamino)-2-chlorobenzoic acid
CAS Number:
1183985-90-1
Molecular Formula:
C8H7ClN2O3
Molecular Weight:
214.6058
MDL Number:
MFCD12165097
IUPAC Name:
5-(carbamoylamino)-2-chlorobenzoic acid
InChI:
InChI=1S/C8H7ClN2O3/c9-6-2-1-4(11-8(10)14)3-5(6)7(12)13/h1-3H,(H,12,13)(H3,10,11,14)
InChI Key:
FTEUNQDHAWIUHT-UHFFFAOYSA-N
SMILES:
NC(=O)Nc1ccc(c(c1)C(=O)O)Cl
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.015g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
214.605g/mol
Monoisotopic Mass:
214.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties