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Home > Indoles and Oxindole > 1248551-74-7
1248551-74-7 | 1,3,3,7-Tetramethyl-5-nitro-1,3-dihydro-2H-indol-2-one
CAS No: 1248551-74-7 Catalog No: AG00HHTC MDL No:MFCD17265873
Product Description
Catalog Number:
AG00HHTC
Chemical Name:
1,3,3,7-Tetramethyl-5-nitro-1,3-dihydro-2H-indol-2-one
CAS Number:
1248551-74-7
Molecular Formula:
C12H14N2O3
Molecular Weight:
234.2512
MDL Number:
MFCD17265873
IUPAC Name:
1,3,3,7-tetramethyl-5-nitroindol-2-one
InChI:
InChI=1S/C12H14N2O3/c1-7-5-8(14(16)17)6-9-10(7)13(4)11(15)12(9,2)3/h5-6H,1-4H3
InChI Key:
CKYUFXYKKWJKCC-UHFFFAOYSA-N
SMILES:
O=C1N(C)c2c(C1(C)C)cc(cc2C)[N+](=O)[O-]
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.1g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.255g/mol
Monoisotopic Mass:
234.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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