Home Halogens 5-bromo-3-nitro-1H-indole

5-bromo-3-nitro-1H-indole

CAS No.:
1260655-97-7
Catalog Number:
AG01A44P
Molecular Formula:
C8H5BrN2O2
Molecular Weight:
241.0415
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Product Description
Catalog Number:
AG01A44P
Chemical Name:
5-bromo-3-nitro-1H-indole
CAS Number:
1260655-97-7
Molecular Formula:
C8H5BrN2O2
Molecular Weight:
241.0415
MDL Number:
MFCD15526778
IUPAC Name:
5-bromo-3-nitro-1H-indole
InChI:
InChI=1S/C8H5BrN2O2/c9-5-1-2-7-6(3-5)8(4-10-7)11(12)13/h1-4,10H
InChI Key:
OMCFUDPGQYOPBI-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(c[nH]2)[N+](=O)[O-]
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.953g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.044g/mol
Monoisotopic Mass:
239.953g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties