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Home > Indoles and Oxindole > 59223-23-3
59223-23-3 | 3H-Indolium, 5-hydroxy-1,2,3,3-tetramethyl-, iodide
CAS No: 59223-23-3 Catalog No: AG003JIV MDL No:MFCD28166373
Product Description
Catalog Number:
AG003JIV
Chemical Name:
3H-Indolium, 5-hydroxy-1,2,3,3-tetramethyl-, iodide
CAS Number:
59223-23-3
Molecular Formula:
C12H16INO
Molecular Weight:
317.1660
MDL Number:
MFCD28166373
IUPAC Name:
1,2,3,3-tetramethylindol-1-ium-5-ol;iodide
InChI:
InChI=1S/C12H15NO.HI/c1-8-12(2,3)10-7-9(14)5-6-11(10)13(8)4;/h5-7H,1-4H3;1H
InChI Key:
QSSOQZGDUDZIAO-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)C(C)(C)C(=[N+]2C)C.[I-]
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.028g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.17g/mol
Monoisotopic Mass:
317.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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