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499771-20-9 | 2-(Morpholin-2-ylmethyl)isoindoline-1,3-dione
CAS No: 499771-20-9 Catalog No: AG006X2T MDL No:MFCD04115418
Product Description
Catalog Number:
AG006X2T
Chemical Name:
2-(Morpholin-2-ylmethyl)isoindoline-1,3-dione
CAS Number:
499771-20-9
Molecular Formula:
C13H14N2O3
Molecular Weight:
246.2619
MDL Number:
MFCD04115418
IUPAC Name:
2-(morpholin-2-ylmethyl)isoindole-1,3-dione
InChI:
InChI=1S/C13H14N2O3/c16-12-10-3-1-2-4-11(10)13(17)15(12)8-9-7-14-5-6-18-9/h1-4,9,14H,5-8H2
InChI Key:
UXEHWYCZZGPXOH-UHFFFAOYSA-N
SMILES:
O=C1N(CC2OCCNC2)C(=O)c2c1cccc2
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.1g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.266g/mol
Monoisotopic Mass:
246.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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