Home Halogens 6-bromo-8-chloro-3,4-dihydro-2H-1,4-benzoxazine

6-bromo-8-chloro-3,4-dihydro-2H-1,4-benzoxazine

CAS No.:
1536436-09-5
Catalog Number:
AG01BC3Z
Molecular Formula:
C8H7BrClNO
Molecular Weight:
248.5043
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Product Description
Catalog Number:
AG01BC3Z
Chemical Name:
6-bromo-8-chloro-3,4-dihydro-2H-1,4-benzoxazine
CAS Number:
1536436-09-5
Molecular Formula:
C8H7BrClNO
Molecular Weight:
248.5043
MDL Number:
MFCD23883937
IUPAC Name:
6-bromo-8-chloro-3,4-dihydro-2H-1,4-benzoxazine
InChI:
InChI=1S/C8H7BrClNO/c9-5-3-6(10)8-7(4-5)11-1-2-12-8/h3-4,11H,1-2H2
InChI Key:
RPUCEFZYJYIUCI-UHFFFAOYSA-N
SMILES:
Brc1cc2NCCOc2c(c1)Cl
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.94g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.504g/mol
Monoisotopic Mass:
246.94g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties