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89077-08-7

89077-08-7 | 1H-Isoindole, 2-acetyloctahydro-, cis-

CAS No: 89077-08-7 Catalog No: AG0040DW MDL No:

Product Description

Catalog Number:
AG0040DW
Chemical Name:
1H-Isoindole, 2-acetyloctahydro-, cis-
CAS Number:
89077-08-7
Molecular Formula:
C10H17NO
Molecular Weight:
167.2481
IUPAC Name:
1-[(3aS,7aR)-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]ethanone
InChI:
InChI=1S/C10H17NO/c1-8(12)11-6-9-4-2-3-5-10(9)7-11/h9-10H,2-7H2,1H3/t9-,10+
InChI Key:
WWZJSQXYQABEPR-AOOOYVTPSA-N
SMILES:
CC(=O)N1C[C@@H]2[C@H](C1)CCCC2

Properties

Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
167.131g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.252g/mol
Monoisotopic Mass:
167.131g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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