Home Halogens 1-(2-Amino-5-bromo-4-methylphenyl)ethanone

1-(2-Amino-5-bromo-4-methylphenyl)ethanone

CAS No.:
817209-21-5
Catalog Number:
AG00G7T0
Molecular Formula:
C9H10BrNO
Molecular Weight:
228.0858
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Product Description
Catalog Number:
AG00G7T0
Chemical Name:
1-(2-Amino-5-bromo-4-methylphenyl)ethanone
CAS Number:
817209-21-5
Molecular Formula:
C9H10BrNO
Molecular Weight:
228.0858
MDL Number:
MFCD27929196
IUPAC Name:
1-(2-amino-5-bromo-4-methylphenyl)ethanone
InChI:
InChI=1S/C9H10BrNO/c1-5-3-9(11)7(6(2)12)4-8(5)10/h3-4H,11H2,1-2H3
InChI Key:
QLKDROCPSWLPCY-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc(Br)c(cc1N)C
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.995g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
228.089g/mol
Monoisotopic Mass:
226.995g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties