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68104-37-0 | 2-(2,5-dioxopyrrolidin-1-yl)oxycarbonylethyl-trimethyl-azanium iodide
CAS No: 68104-37-0 Catalog No: AG00605N MDL No:
Product Description
Catalog Number:
AG00605N
Chemical Name:
2-(2,5-dioxopyrrolidin-1-yl)oxycarbonylethyl-trimethyl-azanium iodide
CAS Number:
68104-37-0
Molecular Formula:
C10H17IN2O4
Molecular Weight:
356.1575
IUPAC Name:
[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]-trimethylazanium;iodide
InChI:
InChI=1S/C10H17N2O4.HI/c1-12(2,3)7-6-10(15)16-11-8(13)4-5-9(11)14;/h4-7H2,1-3H3;1H/q+1;/p-1
InChI Key:
QXQZTHOSTNLXKE-UHFFFAOYSA-M
SMILES:
O=C(ON1C(=O)CCC1=O)CC[N+](C)(C)C.[I-]
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
356.023g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
356.16g/mol
Monoisotopic Mass:
356.023g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
63.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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