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99365-48-7 | 4-Bromooxindole
CAS No: 99365-48-7 Catalog No: AG0033YL MDL No:MFCD06659911
Product Description
Catalog Number:
AG0033YL
Chemical Name:
4-Bromooxindole
CAS Number:
99365-48-7
Molecular Formula:
C8H6BrNO
Molecular Weight:
212.0433
MDL Number:
MFCD06659911
IUPAC Name:
4-bromo-1,3-dihydroindol-2-one
InChI:
InChI=1S/C8H6BrNO/c9-6-2-1-3-7-5(6)4-8(11)10-7/h1-3H,4H2,(H,10,11)
InChI Key:
XQQPPAZTHUEMPF-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1)c(Br)ccc2
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.963g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.046g/mol
Monoisotopic Mass:
210.963g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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