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2-[4-[[3-(acetyl-ethyl-amino)-2,4,6-triiodo-benzoyl]amino]phenyl]acetic acid

2-[4-[[3-(acetyl-ethyl-amino)-2,4,6-triiodo-benzoyl]amino]phenyl]acetic acid structure

CAS No:
22708-43-6
Formula:
C19H17I3N2O4
Chemical Name:
2-[4-[[3-(acetyl-ethyl-amino)-2,4,6-triiodo-benzoyl]amino]phenyl]acetic acid
Synonyms:
BRN 2789547;Acetic acid, (p-(3-(N-ethylacetamido)-2,4,6-triiodobenzamido)phenyl)-;(p-(3-(N-Ethylacetamido)-2,4,6-triiodobenzamido)phenyl)acetic acid;Benzeneacetic acid, 4-((3-(acetylethylamino)-2,4,6-triiodobenzoyl)amino)-;(4-(3-(N-Aethyl-acetylamino)-2,4,6-trijod-benzoylamino)-phenyl)-essigsaure [German];2-[4-[[3-(acetylethylamino)-2,4,6-triiodobenzoyl]amino]phenyl]acetic acid;CTK4F0000;DTXSID50177236;ZINC95861007;(4-(3-(N-Aethyl-acetylamino)-2,4,6-trijod-benzoylamino)-phenyl)-essigsaure

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2-[4-[[3-(acetyl-ethyl-amino)-2,4,6-triiodo-benzoyl]amino]phenyl]acetic acid Basic Attributes

Molecular Weight：

718.068

Exact Mass：

717.832

DSSTox ID：

DTXSID50177236

Characteristics

PSA：

86.7

XLogP3：

3.9

Computed Properties

Molecular Weight:718.1
XLogP3:3.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:717.8322
Monoisotopic Mass:717.8322
Topological Polar Surface Area:86.7
Heavy Atom Count:28
Complexity:584
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[4-[[3-(acetyl-ethyl-amino)-2,4,6-triiodo-benzoyl]amino]phenyl]acetic acid

Basic Attributes
Characteristics
Computed Properties
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2-[4-[[3-(acetyl-ethyl-amino)-2,4,6-triiodo-benzoyl]amino]phenyl]acetic acid

SDS

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