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2-(2-Methoxyethylthio)-3-Methylnaphthalene-1,4-dione

2-(2-Methoxyethylthio)-3-Methylnaphthalene-1,4-dione structure

CAS No:
255906-59-3
Formula:
C14H14O3S
Chemical Name:
2-(2-Methoxyethylthio)-3-Methylnaphthalene-1,4-dione
Synonyms:
VK3-OCH3;2-[(2-Methoxyethyl)thio]-3-methyl-1,4-napthalenedione;2-(2-Methoxyethylthio)-3-Methylnaphthalene-1,4-dione;100571;2-[(2-Methoxy)ethylthio]-3-methyl-1,4-naphthoquinone;2-[(2-Methoxy)ethylthio]-3-methyl-1,4-na;1,4-Naphthalenedione, 2-[(2-methoxyethyl)thio]-3-methyl-

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2-(2-Methoxyethylthio)-3-Methylnaphthalene-1,4-dione Basic Attributes

Molecular Weight：

262.32

Exact Mass：

262.06636548

EC Number：

803-593-1

DSSTox ID：

DTXSID80432623

HScode：

2930909090

Characteristics

PSA：

68.67000

XLogP3：

2.71920

Density：

1.25±0.1 g/cm3

Boiling Point：

395.2±42.0 °C(Predicted)

Safety Information

Transport codes：

UN 3077 9 / PGIII

wgk germany：

hazard class code：

safety instructions：

Marks：

Precautionary statement(s)：

P273

Hazard Statements：

H400

2-(2-Methoxyethylthio)-3-Methylnaphthalene-1,4-dione Use and Manufacturing

A vitamin K3 analogue that has been shown through study to induce cytotoxicity in tumor neuroblastoma, cancerous (malignant) tissue that develops from nerve cells.

Computed Properties

Molecular Weight:262.33
XLogP3:1.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:262.06636548
Monoisotopic Mass:262.06636548
Topological Polar Surface Area:68.7
Heavy Atom Count:18
Complexity:387
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(2-Methoxyethylthio)-3-Methylnaphthalene-1,4-dione

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties

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