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5-[[2-(Acetyloxy)acetyl]amino]-2,4,6-triiodo-1,3-benzenedicarbonyl Dichloride

5-[[2-(Acetyloxy)acetyl]amino]-2,4,6-triiodo-1,3-benzenedicarbonyl Dichloride structure

CAS No:
78314-12-2
Formula:
C12H6Cl2I3NO5
Chemical Name:
5-[[2-(Acetyloxy)acetyl]amino]-2,4,6-triiodo-1,3-benzenedicarbonyl Dichloride
Synonyms:
5-[[2-(ACETYLOXY)ACETYL]AMINO]-2,4,6-TRIIODO-1,3-BENZENEDICARBONYL DICHLORIDE;SCHEMBL708587;DTXSID10513550;ZINC72399330;FT-0661321;5-acetoxyacetamido-2,4,6-triiodoisophthaloyl chloride;[2-(3,5-dicarbonochloridoyl-2,4,6-triiodoanilino)-2-oxoethyl] acetate;2-[3,5-Bis(chlorocarbonyl)-2,4,6-triiodoanilino]-2-oxoethyl acetate;Acetic acid (3,5-bis-chlorocarbonyl-2,4,6-triiodo-phenylcarbamoyl)-methyl ester

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5-[[2-(Acetyloxy)acetyl]amino]-2,4,6-triiodo-1,3-benzenedicarbonyl Dichloride Basic Attributes

Molecular Weight：

695.79915

Exact Mass：

694.676

DSSTox ID：

DTXSID10513550

Characteristics

PSA：

89.5

XLogP3：

5-[[2-(Acetyloxy)acetyl]amino]-2,4,6-triiodo-1,3-benzenedicarbonyl Dichloride Use and Manufacturing

Intermediate in the production of contrast agents for X-ray imaging.

Computed Properties

Molecular Weight:695.80
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:694.6757
Monoisotopic Mass:694.6757
Topological Polar Surface Area:89.5
Heavy Atom Count:23
Complexity:493
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-[[2-(Acetyloxy)acetyl]amino]-2,4,6-triiodo-1,3-benzenedicarbonyl Dichloride

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties
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5-[[2-(Acetyloxy)acetyl]amino]-2,4,6-triiodo-1,3-benzenedicarbonyl Dichloride

SDS

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