2-methyl-octahydro-1H-isoindol-5-amine, Mixture of diastereomers


Chemical Name: 2-methyl-octahydro-1H-isoindol-5-amine, Mixture of diastereomers
CAS Number: 1559682-91-5
Product Number: AG01DTBT(AG01DTBT)
Synonyms:
MDL No:
Molecular Formula: C9H18N2
Molecular Weight: 154.2526

Identification/Properties


Computed Properties
Molecular Weight:
154.257g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
154.147g/mol
Monoisotopic Mass:
154.147g/mol
Topological Polar Surface Area:
29.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
147
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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