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Home > Indoles and Oxindole > 929117-21-5
929117-21-5 | 1H-Isoindol-1-one, 2-[(1S)-2-cyclohexyl-1-methylethyl]-2,3-dihydro-
CAS No: 929117-21-5 Catalog No: AG006K9K MDL No:
Product Description
Catalog Number:
AG006K9K
Chemical Name:
1H-Isoindol-1-one, 2-[(1S)-2-cyclohexyl-1-methylethyl]-2,3-dihydro-
CAS Number:
929117-21-5
Molecular Formula:
C17H23NO
Molecular Weight:
257.3706
IUPAC Name:
2-[(2S)-1-cyclohexylpropan-2-yl]-3H-isoindol-1-one
InChI:
InChI=1S/C17H23NO/c1-13(11-14-7-3-2-4-8-14)18-12-15-9-5-6-10-16(15)17(18)19/h5-6,9-10,13-14H,2-4,7-8,11-12H2,1H3/t13-/m0/s1
InChI Key:
LWMSKYCCQPOQFK-ZDUSSCGKSA-N
SMILES:
C[C@H](N1Cc2c(C1=O)cccc2)CC1CCCCC1
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
257.178g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.377g/mol
Monoisotopic Mass:
257.178g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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