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150807-29-7 | Acetamide,N-[3-[(2,5-dioxo-1-pyrrolidinyl)oxy]-3-oxopropyl]-2-iodo- (9CI)
CAS No: 150807-29-7 Catalog No: AG007XEJ MDL No:
Product Description
Catalog Number:
AG007XEJ
Chemical Name:
Acetamide,N-[3-[(2,5-dioxo-1-pyrrolidinyl)oxy]-3-oxopropyl]-2-iodo- (9CI)
CAS Number:
150807-29-7
Molecular Formula:
C9H11IN2O5
Molecular Weight:
354.0985
IUPAC Name:
(2,5-dioxopyrrolidin-1-yl) 3-[(2-iodoacetyl)amino]propanoate
InChI:
InChI=1S/C9H11IN2O5/c10-5-6(13)11-4-3-9(16)17-12-7(14)1-2-8(12)15/h1-5H2,(H,11,13)
InChI Key:
VXLZRIVUWUUBBG-UHFFFAOYSA-N
SMILES:
ICC(=O)NCCC(=O)ON1C(=O)CCC1=O
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.971g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
354.1g/mol
Monoisotopic Mass:
353.971g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
92.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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