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872271-71-1 | 5,7-Dibromo-3,3-dimethylindolin-2-one
CAS No: 872271-71-1 Catalog No: AG003MAJ MDL No:MFCD12546484
Product Description
Catalog Number:
AG003MAJ
Chemical Name:
5,7-Dibromo-3,3-dimethylindolin-2-one
CAS Number:
872271-71-1
Molecular Formula:
C10H9Br2NO
Molecular Weight:
318.9926
MDL Number:
MFCD12546484
IUPAC Name:
5,7-dibromo-3,3-dimethyl-1H-indol-2-one
InChI:
InChI=1S/C10H9Br2NO/c1-10(2)6-3-5(11)4-7(12)8(6)13-9(10)14/h3-4H,1-2H3,(H,13,14)
InChI Key:
MJVOOYJHLGGINK-UHFFFAOYSA-N
SMILES:
Brc1cc(Br)c2c(c1)C(C)(C)C(=O)N2
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.903g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
318.996g/mol
Monoisotopic Mass:
316.905g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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