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132993-66-9 | 3H-Indol-3-one, 1-acetyl-2-bromo-1,2-dihydro-
CAS No: 132993-66-9 Catalog No: AG0011GL MDL No:
Product Description
Catalog Number:
AG0011GL
Chemical Name:
3H-Indol-3-one, 1-acetyl-2-bromo-1,2-dihydro-
CAS Number:
132993-66-9
Molecular Formula:
C10H8BrNO2
Molecular Weight:
254.0800
IUPAC Name:
1-acetyl-2-bromo-2H-indol-3-one
InChI:
InChI=1S/C10H8BrNO2/c1-6(13)12-8-5-3-2-4-7(8)9(14)10(12)11/h2-5,10H,1H3
InChI Key:
HUTBNQPJWDFZIB-UHFFFAOYSA-N
SMILES:
CC(=O)N1c2ccccc2C(=O)C1Br
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.974g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.083g/mol
Monoisotopic Mass:
252.974g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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