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1000343-29-2 | Ethanone, 1-(7-bromo-5-chloro-2,3-dihydro-1H-indol-1-yl)-
CAS No: 1000343-29-2 Catalog No: AG0000KO MDL No:
Product Description
Catalog Number:
AG0000KO
Chemical Name:
Ethanone, 1-(7-bromo-5-chloro-2,3-dihydro-1H-indol-1-yl)-
CAS Number:
1000343-29-2
Molecular Formula:
C10H9BrClNO
Molecular Weight:
274.5416
IUPAC Name:
1-(7-bromo-5-chloro-2,3-dihydroindol-1-yl)ethanone
InChI:
InChI=1S/C10H9BrClNO/c1-6(14)13-3-2-7-4-8(12)5-9(11)10(7)13/h4-5H,2-3H2,1H3
InChI Key:
BZUAZYHWTWYEKC-UHFFFAOYSA-N
SMILES:
Clc1cc(Br)c2c(c1)CCN2C(=O)C
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.956g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.542g/mol
Monoisotopic Mass:
272.956g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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