Home Halogens 7-bromo-1H,3H,4H-pyrrolo[2,1-c][1,4]oxazine-1,3-dione

7-bromo-1H,3H,4H-pyrrolo[2,1-c][1,4]oxazine-1,3-dione

CAS No.:
2092438-66-7
Catalog Number:
AG01BS4N
Molecular Formula:
C7H4BrNO3
Molecular Weight:
230.0156
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Product Description
Catalog Number:
AG01BS4N
Chemical Name:
7-bromo-1H,3H,4H-pyrrolo[2,1-c][1,4]oxazine-1,3-dione
CAS Number:
2092438-66-7
Molecular Formula:
C7H4BrNO3
Molecular Weight:
230.0156
MDL Number:
MFCD30749965
IUPAC Name:
7-bromo-4H-pyrrolo[2,1-c][1,4]oxazine-1,3-dione
InChI:
InChI=1S/C7H4BrNO3/c8-4-1-5-7(11)12-6(10)3-9(5)2-4/h1-2H,3H2
InChI Key:
KDIZECGVNORCGC-UHFFFAOYSA-N
SMILES:
Brc1cn2c(c1)C(=O)OC(=O)C2
Properties
Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.937g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.017g/mol
Monoisotopic Mass:
228.937g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
48.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties