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37147-81-2 | Pyrrolidinium, 1-[2-(acetyloxy)ethyl]-1-methyl-, iodide
CAS No: 37147-81-2 Catalog No: AG007AGM MDL No:
Product Description
Catalog Number:
AG007AGM
Chemical Name:
Pyrrolidinium, 1-[2-(acetyloxy)ethyl]-1-methyl-, iodide
CAS Number:
37147-81-2
Molecular Formula:
C9H18INO2
Molecular Weight:
299.1492
IUPAC Name:
2-(1-methylpyrrolidin-1-ium-1-yl)ethyl acetate;iodide
InChI:
InChI=1S/C9H18NO2.HI/c1-9(11)12-8-7-10(2)5-3-4-6-10;/h3-8H2,1-2H3;1H/q+1;/p-1
InChI Key:
HGUZAZPNVZUUHX-UHFFFAOYSA-M
SMILES:
CC(=O)OCC[N+]1(C)CCCC1.[I-]
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.038g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.152g/mol
Monoisotopic Mass:
299.038g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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