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NK 2045

NK 2045 structure

NK 2045 

structure
  • CAS No:

    25962-03-2

  • Formula:

    C16H14N2O3S3

  • Chemical Name:

    NK 2045

  • Synonyms:

    3-Thiazolidineacetic acid,5-[2-(3-ethyl-2(3H)-benzothiazolylidene)ethylidene]-4-oxo-2-thioxo-;3-Thiazolidineacetic acid,5-[2-(3-ethyl-2-benzothiazolinylidene)ethylidene]-4-oxo-2-thioxo-;3-Thiazolidineacetic acid,5-[(3-ethyl-2(3H)-benzothiazolylidene)ethylidene]-4-oxo-2-thioxo-;5-[2-(3-Ethyl-2(3H)-benzothiazolylidene)ethylidene]-4-oxo-2-thioxo-3-thiazolidineacetic acid;3-Carboxymethyl-5-[(3-ethyl-2-benzothiazolinylidene)ethylidene]rhodanine;3-Carboxymethyl-5-[β-(3-ethyl-2(3H)-benzothiazolylidene)ethylidene]rhodanine;G 1875;M 8;M 8 (dye);NK 2045;3-Carboxymethyl-5-[2-(3-ethylbenzothiazoline)dimethine]rhodanine;Merocyanine MC 2;[5-[2-(3-Ethyl-3H-benzothiazol-2-ylidene)ethylidene]-4-oxo-2-thioxothiazolidin-3-yl]acetic acid;100843-18-3;125295-41-2

NK 2045 Basic Attributes

378.48896

378.49

247-373-8

DTXSID7067162

Characteristics

148.17000

2.55100

1.57g/cm3

273-278 °C (decomp)

497.3ºC at 760mmHg

254.5ºC

1.784

Safety Information

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P321, P332+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

NK 2045 Use and Manufacturing

3-Thiazolidineacetic acid, 5-[2-(3-ethyl-2(3H)-benzothiazolylidene)ethylidene]-4-oxo-2-thioxo-: INACTIVE

Computed Properties

Molecular Weight:378.5
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:378.01665583
Monoisotopic Mass:378.01665583
Topological Polar Surface Area:144
Heavy Atom Count:24
Complexity:632
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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