Home Halogens 4(3H)-Quinazolinone, 6-bromo-2-chloro-

4(3H)-Quinazolinone, 6-bromo-2-chloro-

CAS No.:
167158-70-5
Catalog Number:
AG001X5M
Molecular Formula:
C8H4BrClN2O
Molecular Weight:
259.4872
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Product Description
Catalog Number:
AG001X5M
Chemical Name:
4(3H)-Quinazolinone, 6-bromo-2-chloro-
CAS Number:
167158-70-5
Molecular Formula:
C8H4BrClN2O
Molecular Weight:
259.4872
IUPAC Name:
6-bromo-2-chloro-3H-quinazolin-4-one
InChI:
InChI=1S/C8H4BrClN2O/c9-4-1-2-6-5(3-4)7(13)12-8(10)11-6/h1-3H,(H,11,12,13)
InChI Key:
WZVAPPYRAGWFKW-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(=O)[nH]c(n2)Cl
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.92g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
259.487g/mol
Monoisotopic Mass:
257.92g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties