2-Bromo-8-fluoro-4,5-dihydro-1H-azepino[5,4,3-cd]indol-6(3H)-one


Chemical Name: 2-Bromo-8-fluoro-4,5-dihydro-1H-azepino[5,4,3-cd]indol-6(3H)-one
CAS Number: 283173-80-8
Product Number: AG00BGLE(AGN-PC-0WAMIG)
Synonyms:
MDL No: MFCD23703297
Molecular Formula: C11H8BrFN2O
Molecular Weight: 283.0964

Identification/Properties


Computed Properties
Molecular Weight:
283.1g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
281.98g/mol
Monoisotopic Mass:
281.98g/mol
Topological Polar Surface Area:
44.9A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
314
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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