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124939-50-0 | 2-(piperidin-4-ylmethyl)-2,3-dihydro-1H-isoindole-1,3-dione hydrochloride
CAS No: 124939-50-0 Catalog No: AG019VGK MDL No:MFCD12197163
Product Description
Catalog Number:
AG019VGK
Chemical Name:
2-(piperidin-4-ylmethyl)-2,3-dihydro-1H-isoindole-1,3-dione hydrochloride
CAS Number:
124939-50-0
Molecular Formula:
C14H17ClN2O2
Molecular Weight:
280.7500
MDL Number:
MFCD12197163
IUPAC Name:
2-(piperidin-4-ylmethyl)isoindole-1,3-dione;hydrochloride
InChI:
InChI=1S/C14H16N2O2.ClH/c17-13-11-3-1-2-4-12(11)14(18)16(13)9-10-5-7-15-8-6-10;/h1-4,10,15H,5-9H2;1H
InChI Key:
DYLHPNGHVFENRV-UHFFFAOYSA-N
SMILES:
O=C1N(CC2CCNCC2)C(=O)c2c1cccc2.Cl
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.098g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
280.752g/mol
Monoisotopic Mass:
280.098g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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