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Home > Indoles and Oxindole > 18781-58-3
18781-58-3 | 1H-Indole, 2,3-dihydro-2,3,3-trimethyl-
CAS No: 18781-58-3 Catalog No: AG002GIR MDL No:MFCD00799248
Product Description
Catalog Number:
AG002GIR
Chemical Name:
1H-Indole, 2,3-dihydro-2,3,3-trimethyl-
CAS Number:
18781-58-3
Molecular Formula:
C11H15N
Molecular Weight:
161.2435
MDL Number:
MFCD00799248
IUPAC Name:
2,3,3-trimethyl-1,2-dihydroindole
InChI:
InChI=1S/C11H15N/c1-8-11(2,3)9-6-4-5-7-10(9)12-8/h4-8,12H,1-3H3
InChI Key:
IVWSGOOPQGMALJ-UHFFFAOYSA-N
SMILES:
CC1Nc2c(C1(C)C)cccc2
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.12g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.248g/mol
Monoisotopic Mass:
161.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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