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Home > Indoles and Oxindole > 97142-01-3
97142-01-3 | 1H-Isoindole, 2,3-dihydro-1,1,3,3-tetramethyl-2-(1-phenylethoxy)-
CAS No: 97142-01-3 Catalog No: AG006NQW MDL No:
Product Description
Catalog Number:
AG006NQW
Chemical Name:
1H-Isoindole, 2,3-dihydro-1,1,3,3-tetramethyl-2-(1-phenylethoxy)-
CAS Number:
97142-01-3
Molecular Formula:
C20H25NO
Molecular Weight:
295.4186
IUPAC Name:
1,1,3,3-tetramethyl-2-(1-phenylethoxy)isoindole
InChI:
InChI=1S/C20H25NO/c1-15(16-11-7-6-8-12-16)22-21-19(2,3)17-13-9-10-14-18(17)20(21,4)5/h6-15H,1-5H3
InChI Key:
SUYYOCUJOMBBJR-UHFFFAOYSA-N
SMILES:
CC(c1ccccc1)ON1C(C)(C)c2c(C1(C)C)cccc2
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.194g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.426g/mol
Monoisotopic Mass:
295.194g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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