Home Halogens (4-bromo-3-methylphenyl)urea

(4-bromo-3-methylphenyl)urea

CAS No.:
78508-46-0
Catalog Number:
AG01A88S
Molecular Formula:
C8H9BrN2O
Molecular Weight:
229.0739
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Product Description
Catalog Number:
AG01A88S
Chemical Name:
(4-bromo-3-methylphenyl)urea
CAS Number:
78508-46-0
Molecular Formula:
C8H9BrN2O
Molecular Weight:
229.0739
MDL Number:
MFCD09815545
IUPAC Name:
(4-bromo-3-methylphenyl)urea
InChI:
InChI=1S/C8H9BrN2O/c1-5-4-6(11-8(10)12)2-3-7(5)9/h2-4H,1H3,(H3,10,11,12)
InChI Key:
CRGNBCADENCADB-UHFFFAOYSA-N
SMILES:
NC(=O)Nc1ccc(c(c1)C)Br
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.99g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
229.077g/mol
Monoisotopic Mass:
227.99g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties