Home Halogens 6-bromo-8-fluoroquinazolin-4-ol

6-bromo-8-fluoroquinazolin-4-ol

CAS No.:
1209498-47-4
Catalog Number:
AG019ZAF
Molecular Formula:
C8H4BrFN2O
Molecular Weight:
243.0326
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Product Description
Catalog Number:
AG019ZAF
Chemical Name:
6-bromo-8-fluoroquinazolin-4-ol
CAS Number:
1209498-47-4
Molecular Formula:
C8H4BrFN2O
Molecular Weight:
243.0326
MDL Number:
MFCD22369878
IUPAC Name:
6-bromo-8-fluoro-3H-quinazolin-4-one
InChI:
InChI=1S/C8H4BrFN2O/c9-4-1-5-7(6(10)2-4)11-3-12-8(5)13/h1-3H,(H,11,12,13)
InChI Key:
CXKSQZXRXUJVGQ-UHFFFAOYSA-N
SMILES:
Brc1cc(F)c2c(c1)c(O)ncn2
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.949g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
243.035g/mol
Monoisotopic Mass:
241.949g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties