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51101-44-1 | 4-(iodomethyl)pyrrolidin-2-one
CAS No: 51101-44-1 Catalog No: AG01C2UJ MDL No:MFCD29060316
Product Description
Catalog Number:
AG01C2UJ
Chemical Name:
4-(iodomethyl)pyrrolidin-2-one
CAS Number:
51101-44-1
Molecular Formula:
C5H8INO
Molecular Weight:
225.0276
MDL Number:
MFCD29060316
IUPAC Name:
4-(iodomethyl)pyrrolidin-2-one
InChI:
InChI=1S/C5H8INO/c6-2-4-1-5(8)7-3-4/h4H,1-3H2,(H,7,8)
InChI Key:
DOFCYFZAIZKPIY-UHFFFAOYSA-N
SMILES:
ICC1CNC(=O)C1
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:
1
Isotope Atom Count:
0
Molecular Weight:
225.029g/mol
Monoisotopic Mass:
224.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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