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Home > Indoles and Oxindole > 180003-61-6
180003-61-6 | 3H-Indole, 2,3,3-trimethyl-6-phenyl-
CAS No: 180003-61-6 Catalog No: AG0021L1 MDL No:
Product Description
Catalog Number:
AG0021L1
Chemical Name:
3H-Indole, 2,3,3-trimethyl-6-phenyl-
CAS Number:
180003-61-6
Molecular Formula:
C17H17N
Molecular Weight:
235.3236
IUPAC Name:
2,3,3-trimethyl-6-phenylindole
InChI:
InChI=1S/C17H17N/c1-12-17(2,3)15-10-9-14(11-16(15)18-12)13-7-5-4-6-8-13/h4-11H,1-3H3
InChI Key:
GXIAISSARIHOAL-UHFFFAOYSA-N
SMILES:
CC1=Nc2c(C1(C)C)ccc(c2)c1ccccc1
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.136g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.33g/mol
Monoisotopic Mass:
235.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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