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1787068-88-5 | (R)-2-(Pyrrolidin-3-yl)isoindolin-1-one
CAS No: 1787068-88-5 Catalog No: AG01EUEI MDL No:
Product Description
Catalog Number:
AG01EUEI
Chemical Name:
(R)-2-(Pyrrolidin-3-yl)isoindolin-1-one
CAS Number:
1787068-88-5
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
IUPAC Name:
2-[(3R)-pyrrolidin-3-yl]-3H-isoindol-1-one
InChI:
InChI=1S/C12H14N2O/c15-12-11-4-2-1-3-9(11)8-14(12)10-5-6-13-7-10/h1-4,10,13H,5-8H2/t10-/m1/s1
InChI Key:
VWSCJPFMSDBIHM-SNVBAGLBSA-N
SMILES:
O=C1N(Cc2c1cccc2)[C@H]1CNCC1
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
202.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.257g/mol
Monoisotopic Mass:
202.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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