Home Other Building Blocks 8-BROMO-1H,2H,3H,3AH,4H,5H-PYRROLO[1,2-A]QUINOXALIN-4-ONE

8-BROMO-1H,2H,3H,3AH,4H,5H-PYRROLO[1,2-A]QUINOXALIN-4-ONE

CAS No.:
305790-77-6
Catalog Number:
AG01ELQ7
Molecular Formula:
C11H11BrN2O
Molecular Weight:
267.1218
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Product Description
Catalog Number:
AG01ELQ7
Chemical Name:
8-BROMO-1H,2H,3H,3AH,4H,5H-PYRROLO[1,2-A]QUINOXALIN-4-ONE
CAS Number:
305790-77-6
Molecular Formula:
C11H11BrN2O
Molecular Weight:
267.1218
MDL Number:
MFCD21840739
IUPAC Name:
8-bromo-2,3,3a,5-tetrahydro-1H-pyrrolo[1,2-a]quinoxalin-4-one
InChI:
InChI=1S/C11H11BrN2O/c12-7-3-4-8-10(6-7)14-5-1-2-9(14)11(15)13-8/h3-4,6,9H,1-2,5H2,(H,13,15)
InChI Key:
OXWUVWWEFWTUFB-UHFFFAOYSA-N
SMILES:
O=C1Nc2ccc(cc2N2C1CCC2)Br
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.005g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
267.126g/mol
Monoisotopic Mass:
266.005g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties