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Home > Indoles and Oxindole > 2475-68-5
2475-68-5 | 5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione
CAS No: 2475-68-5 Catalog No: AG019UA3 MDL No:MFCD09730111
Product Description
Catalog Number:
AG019UA3
Chemical Name:
5-tert-butyl-2,3-dihydro-1H-indole-2,3-dione
CAS Number:
2475-68-5
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
MDL Number:
MFCD09730111
IUPAC Name:
5-tert-butyl-1H-indole-2,3-dione
InChI:
InChI=1S/C12H13NO2/c1-12(2,3)7-4-5-9-8(6-7)10(14)11(15)13-9/h4-6H,1-3H3,(H,13,14,15)
InChI Key:
FQRSABMKACVJDD-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1=O)cc(cc2)C(C)(C)C
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.241g/mol
Monoisotopic Mass:
203.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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