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Home > Indoles and Oxindole > 1787191-35-8
1787191-35-8 | (S)-2-(Pyrrolidin-3-yl)isoindolin-1-onehydrochloride
CAS No: 1787191-35-8 Catalog No: AG01EUEK MDL No:
Product Description
Catalog Number:
AG01EUEK
Chemical Name:
(S)-2-(Pyrrolidin-3-yl)isoindolin-1-onehydrochloride
CAS Number:
1787191-35-8
Molecular Formula:
C12H15ClN2O
Molecular Weight:
238.7133
IUPAC Name:
2-[(3S)-pyrrolidin-3-yl]-3H-isoindol-1-one;hydrochloride
InChI:
InChI=1S/C12H14N2O.ClH/c15-12-11-4-2-1-3-9(11)8-14(12)10-5-6-13-7-10;/h1-4,10,13H,5-8H2;1H/t10-;/m0./s1
InChI Key:
HEECAGMETSERNO-PPHPATTJSA-N
SMILES:
O=C1N(Cc2c1cccc2)[C@@H]1CNCC1.Cl
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
238.087g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
238.715g/mol
Monoisotopic Mass:
238.087g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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