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Home > Indoles and Oxindole > 89077-09-8
89077-09-8 | 1H-Isoindole, 2-acetyloctahydro-1-methoxy-
CAS No: 89077-09-8 Catalog No: AG0040XS MDL No:
Product Description
Catalog Number:
AG0040XS
Chemical Name:
1H-Isoindole, 2-acetyloctahydro-1-methoxy-
CAS Number:
89077-09-8
Molecular Formula:
C11H19NO2
Molecular Weight:
197.2741
IUPAC Name:
1-(1-methoxy-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl)ethanone
InChI:
InChI=1S/C11H19NO2/c1-8(13)12-7-9-5-3-4-6-10(9)11(12)14-2/h9-11H,3-7H2,1-2H3
InChI Key:
XVSUZEMBOTYDOC-UHFFFAOYSA-N
SMILES:
COC1C2CCCCC2CN1C(=O)C
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.142g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.278g/mol
Monoisotopic Mass:
197.142g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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