Home Aminos 2-[4-(methylamino)cyclohexyl]-2,3-dihydro-1H-isoindole-1,3-dione hydrochloride, Mixture of isomers

2-[4-(methylamino)cyclohexyl]-2,3-dihydro-1H-isoindole-1,3-dione hydrochloride, Mixture of isomers

CAS No.:
2138086-92-5
Catalog Number:
AG01EJ9C
Molecular Formula:
C15H19ClN2O2
Molecular Weight:
294.7766
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Product Description
Catalog Number:
AG01EJ9C
Chemical Name:
2-[4-(methylamino)cyclohexyl]-2,3-dihydro-1H-isoindole-1,3-dione hydrochloride, Mixture of isomers
CAS Number:
2138086-92-5
Molecular Formula:
C15H19ClN2O2
Molecular Weight:
294.7766
MDL Number:
MFCD31558991
IUPAC Name:
2-[4-(methylamino)cyclohexyl]isoindole-1,3-dione;hydrochloride
InChI:
InChI=1S/C15H18N2O2.ClH/c1-16-10-6-8-11(9-7-10)17-14(18)12-4-2-3-5-13(12)15(17)19;/h2-5,10-11,16H,6-9H2,1H3;1H
InChI Key:
HILAUWRJZXQCBC-UHFFFAOYSA-N
SMILES:
CNC1CCC(CC1)N1C(=O)c2c(C1=O)cccc2.Cl
Properties
Complexity:
350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.114g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
294.779g/mol
Monoisotopic Mass:
294.114g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties