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Home > Indoles and Oxindole > 959277-01-1
959277-01-1 | 3,3,4,7-TETRAMETHYL-2,3-DIHYDRO-1H-INDOL-2-ONE
CAS No: 959277-01-1 Catalog No: AG01BUHU MDL No:MFCD21984901
Product Description
Catalog Number:
AG01BUHU
Chemical Name:
3,3,4,7-TETRAMETHYL-2,3-DIHYDRO-1H-INDOL-2-ONE
CAS Number:
959277-01-1
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD21984901
IUPAC Name:
3,3,4,7-tetramethyl-1H-indol-2-one
InChI:
InChI=1S/C12H15NO/c1-7-5-6-8(2)10-9(7)12(3,4)11(14)13-10/h5-6H,1-4H3,(H,13,14)
InChI Key:
RTIJVQHVSHBAOX-UHFFFAOYSA-N
SMILES:
Cc1ccc(c2c1NC(=O)C2(C)C)C
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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