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Home > Indoles and Oxindole > 91639-45-1
91639-45-1 | 2,3,5,7-tetramethyl-1H-indole
CAS No: 91639-45-1 Catalog No: AG00IGT3 MDL No:MFCD16619535
Product Description
Catalog Number:
AG00IGT3
Chemical Name:
2,3,5,7-tetramethyl-1H-indole
CAS Number:
91639-45-1
Molecular Formula:
C12H15N
Molecular Weight:
173.2542
MDL Number:
MFCD16619535
IUPAC Name:
2,3,5,7-tetramethyl-1H-indole
InChI:
InChI=1S/C12H15N/c1-7-5-8(2)12-11(6-7)9(3)10(4)13-12/h5-6,13H,1-4H3
InChI Key:
ZANFDXMONLVRTH-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c2c(c1)c(C)c([nH]2)C
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.12g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.259g/mol
Monoisotopic Mass:
173.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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