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1354006-99-7 | 1-((S)-3-Iodo-pyrrolidin-1-yl)-ethanone
CAS No: 1354006-99-7 Catalog No: AG01ESVU MDL No:
Product Description
Catalog Number:
AG01ESVU
Chemical Name:
1-((S)-3-Iodo-pyrrolidin-1-yl)-ethanone
CAS Number:
1354006-99-7
Molecular Formula:
C6H10INO
Molecular Weight:
239.0542
IUPAC Name:
1-[(3S)-3-iodopyrrolidin-1-yl]ethanone
InChI:
InChI=1S/C6H10INO/c1-5(9)8-3-2-6(7)4-8/h6H,2-4H2,1H3/t6-/m0/s1
InChI Key:
AJCWBWLVIQIHHI-LURJTMIESA-N
SMILES:
I[C@H]1CCN(C1)C(=O)C
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
238.981g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.056g/mol
Monoisotopic Mass:
238.981g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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