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Home > Bromides > 1000343-23-6
1000343-23-6 | Ethanone, 1-(7-bromo-5-nitro-1H-indol-1-yl)-
CAS No: 1000343-23-6 Catalog No: AG0000KR MDL No:
Product Description
Catalog Number:
AG0000KR
Chemical Name:
Ethanone, 1-(7-bromo-5-nitro-1H-indol-1-yl)-
CAS Number:
1000343-23-6
Molecular Formula:
C10H7BrN2O3
Molecular Weight:
283.0782
IUPAC Name:
1-(7-bromo-5-nitroindol-1-yl)ethanone
InChI:
InChI=1S/C10H7BrN2O3/c1-6(14)12-3-2-7-4-8(13(15)16)5-9(11)10(7)12/h2-5H,1H3
InChI Key:
XYPVOCFWGOBPPW-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(Br)c2c(c1)ccn2C(=O)C
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.964g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.081g/mol
Monoisotopic Mass:
281.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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