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114744-52-4 | Ethanone, 1-(4-bromo-2,3-dihydro-1H-indol-1-yl)-
CAS No: 114744-52-4 Catalog No: AG000F51 MDL No:
Product Description
Catalog Number:
AG000F51
Chemical Name:
Ethanone, 1-(4-bromo-2,3-dihydro-1H-indol-1-yl)-
CAS Number:
114744-52-4
Molecular Formula:
C10H10BrNO
Molecular Weight:
240.0965
IUPAC Name:
1-(4-bromo-2,3-dihydroindol-1-yl)ethanone
InChI:
InChI=1S/C10H10BrNO/c1-7(13)12-6-5-8-9(11)3-2-4-10(8)12/h2-4H,5-6H2,1H3
InChI Key:
SQTJOHUYRUNCDT-UHFFFAOYSA-N
SMILES:
CC(=O)N1CCc2c1cccc2Br
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.995g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.1g/mol
Monoisotopic Mass:
238.995g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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