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Home > Indoles and Oxindole > 1798718-19-0
1798718-19-0 | 2-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-2,3-dihydro-1H-isoindole-1,3-dione hydrochloride
CAS No: 1798718-19-0 Catalog No: AG01BGSI MDL No:MFCD28125238
Product Description
Catalog Number:
AG01BGSI
Chemical Name:
2-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]-2,3-dihydro-1H-isoindole-1,3-dione hydrochloride
CAS Number:
1798718-19-0
Molecular Formula:
C15H17ClN2O2
Molecular Weight:
292.7607
MDL Number:
MFCD28125238
IUPAC Name:
2-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethyl]isoindole-1,3-dione;hydrochloride
InChI:
InChI=1S/C15H16N2O2.ClH/c18-14-12-3-1-2-4-13(12)15(19)17(14)10-7-11-5-8-16-9-6-11;/h1-5,16H,6-10H2;1H
InChI Key:
PUBCINSYESDYCE-UHFFFAOYSA-N
SMILES:
O=C1N(CCC2=CCNCC2)C(=O)c2c1cccc2.Cl
Properties
Complexity:
392
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.098g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
292.763g/mol
Monoisotopic Mass:
292.098g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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