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93287-13-9 | 2-Pyrrolidinone, 1-(iodomethyl)-
CAS No: 93287-13-9 Catalog No: AG0064FA MDL No:
Product Description
Catalog Number:
AG0064FA
Chemical Name:
2-Pyrrolidinone, 1-(iodomethyl)-
CAS Number:
93287-13-9
Molecular Formula:
C5H8INO
Molecular Weight:
225.0276
IUPAC Name:
1-(iodomethyl)pyrrolidin-2-one
InChI:
InChI=1S/C5H8INO/c6-4-7-3-1-2-5(7)8/h1-4H2
InChI Key:
FIJJHWILYAJBJV-UHFFFAOYSA-N
SMILES:
ICN1CCCC1=O
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.965g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.029g/mol
Monoisotopic Mass:
224.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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