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5-(Ethoxymethylene)-3-(2-methylphenyl)-2-thioxo-4-thiazolidinone

5-(Ethoxymethylene)-3-(2-methylphenyl)-2-thioxo-4-thiazolidinone structure

CAS No:
53514-43-5
Formula:
C13H13NO2S2
Chemical Name:
5-(Ethoxymethylene)-3-(2-methylphenyl)-2-thioxo-4-thiazolidinone
Synonyms:
4-Thiazolidinone,5-(ethoxymethylene)-3-(2-methylphenyl)-2-thioxo-;5-(Ethoxymethylene)-3-(2-methylphenyl)-2-thioxo-4-thiazolidinone;NSC 159044

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5-(Ethoxymethylene)-3-(2-methylphenyl)-2-thioxo-4-thiazolidinone Basic Attributes

Molecular Weight：

279.37800

Exact Mass：

279.38

NSC Number：

159044

DSSTox ID：

DTXSID70369671

HScode：

2934999090

Characteristics

PSA：

86.93000

XLogP3：

3.30260

Density：

1.34g/cm3

Boiling Point：

385.9ºC at 760 mmHg

Flash Point：

187.2ºC

Refractive Index：

1.669

Safety Information

GHS Classification：

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:279.4
XLogP3:3.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:279.03877100
Monoisotopic Mass:279.03877100
Topological Polar Surface Area:86.9
Heavy Atom Count:18
Complexity:381
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(Ethoxymethylene)-3-(2-methylphenyl)-2-thioxo-4-thiazolidinone

Basic Attributes
Characteristics
Safety Information
Computed Properties

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