Home Other Building Blocks 1-(3-CHLORO-4-METHYLPHENYL)-3-METHYLUREA

1-(3-CHLORO-4-METHYLPHENYL)-3-METHYLUREA

CAS No.:
22175-22-0
Catalog Number:
AG00BDDC
Molecular Formula:
C9H11ClN2O
Molecular Weight:
198.6494
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Product Description
Catalog Number:
AG00BDDC
Chemical Name:
1-(3-CHLORO-4-METHYLPHENYL)-3-METHYLUREA
CAS Number:
22175-22-0
Molecular Formula:
C9H11ClN2O
Molecular Weight:
198.6494
MDL Number:
MFCD00089111
IUPAC Name:
1-(3-chloro-4-methylphenyl)-3-methylurea
InChI:
InChI=1S/C9H11ClN2O/c1-6-3-4-7(5-8(6)10)12-9(13)11-2/h3-5H,1-2H3,(H2,11,12,13)
InChI Key:
GUMFWXBSFOHZDC-UHFFFAOYSA-N
SMILES:
CNC(=O)Nc1ccc(c(c1)Cl)C
NSC Number:
164350
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.056g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
198.65g/mol
Monoisotopic Mass:
198.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties