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Home > Indoles and Oxindole > 1423117-09-2
1423117-09-2 | 2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-4'-carbonitrile
CAS No: 1423117-09-2 Catalog No: AG01AIEC MDL No:MFCD27920446
Product Description
Catalog Number:
AG01AIEC
Chemical Name:
2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-4'-carbonitrile
CAS Number:
1423117-09-2
Molecular Formula:
C12H11N3O
Molecular Weight:
213.2352
MDL Number:
MFCD27920446
IUPAC Name:
2-oxospiro[1H-indole-3,4'-pyrrolidine]-3'-carbonitrile
InChI:
InChI=1S/C12H11N3O/c13-5-8-6-14-7-12(8)9-3-1-2-4-10(9)15-11(12)16/h1-4,8,14H,6-7H2,(H,15,16)
InChI Key:
OWISKWPQNNOZGG-UHFFFAOYSA-N
SMILES:
N#CC1CNCC21C(=O)Nc1c2cccc1
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
213.24g/mol
Monoisotopic Mass:
213.09g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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