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Home > Indoles and Oxindole > 1439896-47-5
1439896-47-5 | 6-Methoxy-2-(piperidin-4-yl)-2,3-dihydro-1H-isoindol-1-one hydrochloride
CAS No: 1439896-47-5 Catalog No: AG01F4QQ MDL No:
Product Description
Catalog Number:
AG01F4QQ
Chemical Name:
6-Methoxy-2-(piperidin-4-yl)-2,3-dihydro-1H-isoindol-1-one hydrochloride
CAS Number:
1439896-47-5
Molecular Formula:
C14H19ClN2O2
Molecular Weight:
282.7659
IUPAC Name:
6-methoxy-2-piperidin-4-yl-3H-isoindol-1-one;hydrochloride
InChI:
InChI=1S/C14H18N2O2.ClH/c1-18-12-3-2-10-9-16(14(17)13(10)8-12)11-4-6-15-7-5-11;/h2-3,8,11,15H,4-7,9H2,1H3;1H
InChI Key:
WCRAXNMMXIJRSJ-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)C(=O)N(C2)C1CCNCC1.Cl
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.114g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
282.768g/mol
Monoisotopic Mass:
282.114g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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