Home Halogens 3-amino-1-(4-chloro-2,5-dimethoxyphenyl)urea

3-amino-1-(4-chloro-2,5-dimethoxyphenyl)urea

CAS No.:
1152851-50-7
Catalog Number:
AG019Q72
Molecular Formula:
C9H12ClN3O3
Molecular Weight:
245.6629
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Product Description
Catalog Number:
AG019Q72
Chemical Name:
3-amino-1-(4-chloro-2,5-dimethoxyphenyl)urea
CAS Number:
1152851-50-7
Molecular Formula:
C9H12ClN3O3
Molecular Weight:
245.6629
MDL Number:
MFCD11106033
IUPAC Name:
1-amino-3-(4-chloro-2,5-dimethoxyphenyl)urea
InChI:
InChI=1S/C9H12ClN3O3/c1-15-7-4-6(12-9(14)13-11)8(16-2)3-5(7)10/h3-4H,11H2,1-2H3,(H2,12,13,14)
InChI Key:
MKIHNJMCQSDIRW-UHFFFAOYSA-N
SMILES:
COc1cc(Cl)c(cc1NC(=O)NN)OC
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.057g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
245.663g/mol
Monoisotopic Mass:
245.057g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
85.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties