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[2-(2-chloro-5-nitroanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate

[2-(2-chloro-5-nitroanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate structure

CAS No:
562860-25-7
Formula:
C14H10ClN3O6
Chemical Name:
[2-(2-chloro-5-nitroanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate
Synonyms:
MLS002245210;CHEMBL1706689;HMS3093G03;ZINC3290775;AKOS033631243;SMR001308865;SR-01000047973;SR-01000047973-1;Z18554773;3-({[(2-chloro-5-nitrophenyl)carbamoyl]methoxy}carbonyl)pyridin-1-ium-1-olate;562860-25-7

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[2-(2-chloro-5-nitroanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate Basic Attributes

Molecular Weight：

351.70 g/mol

Exact Mass：

351.0258127 g/mol

Characteristics

PSA：

127 Å²

Water Solubility：

>52.8 [ug/mL]

Computed Properties

Molecular Weight:351.70
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:351.0258127
Monoisotopic Mass:351.0258127
Topological Polar Surface Area:127
Heavy Atom Count:24
Complexity:486
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-(2-chloro-5-nitroanilino)-2-oxoethyl] 1-oxidopyridin-1-ium-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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