Home Halogens 2(1H)-Pyridone, 3-(bromoacetyl)- (8CI)

2(1H)-Pyridone, 3-(bromoacetyl)- (8CI)

CAS No.:
27038-46-6
Catalog Number:
AG00BTRB
Molecular Formula:
C7H6BrNO2
Molecular Weight:
216.0320
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Product Description
Catalog Number:
AG00BTRB
Chemical Name:
2(1H)-Pyridone, 3-(bromoacetyl)- (8CI)
CAS Number:
27038-46-6
Molecular Formula:
C7H6BrNO2
Molecular Weight:
216.0320
MDL Number:
MFCD13173354
IUPAC Name:
3-(2-bromoacetyl)-1H-pyridin-2-one
InChI:
InChI=1S/C7H6BrNO2/c8-4-6(10)5-2-1-3-9-7(5)11/h1-3H,4H2,(H,9,11)
InChI Key:
DAAKHIPOICBEDV-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1ccc[nH]c1=O
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.958g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.034g/mol
Monoisotopic Mass:
214.958g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties