Home Halogens 6-Bromo-5-chloro-4H-benzo[1,4]oxazin-3-one

6-Bromo-5-chloro-4H-benzo[1,4]oxazin-3-one

CAS No.:
1154740-66-5
Catalog Number:
AG00970L
Molecular Formula:
C8H5BrClNO2
Molecular Weight:
262.4878
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Product Description
Catalog Number:
AG00970L
Chemical Name:
6-Bromo-5-chloro-4H-benzo[1,4]oxazin-3-one
CAS Number:
1154740-66-5
Molecular Formula:
C8H5BrClNO2
Molecular Weight:
262.4878
MDL Number:
MFCD28402357
IUPAC Name:
6-bromo-5-chloro-4H-1,4-benzoxazin-3-one
InChI:
InChI=1S/C8H5BrClNO2/c9-4-1-2-5-8(7(4)10)11-6(12)3-13-5/h1-2H,3H2,(H,11,12)
InChI Key:
DTSSBFUGQWFOHI-UHFFFAOYSA-N
SMILES:
O=C1COc2c(N1)c(Cl)c(cc2)Br
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.919g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
262.487g/mol
Monoisotopic Mass:
260.919g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties