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[2-(dimethylamino)-1-sulfosulfanylethyl]benzene

[2-(dimethylamino)-1-sulfosulfanylethyl]benzene structure

CAS No:
952-18-1
Formula:
C10H15NO3S2
Chemical Name:
[2-(dimethylamino)-1-sulfosulfanylethyl]benzene
Synonyms:
952-18-1;(+-)-S-(2-(Dimethylamino)-1-phenylethyl) thiosulfate;Thiosulfuric acid, S-(2-(dimethylamino)-1-phenylethyl) ester, (+-)-;DTXSID50915074;S-[2-(dimethylamino)-1-phenylethyl] hydrogen sulfurothioate

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[2-(dimethylamino)-1-sulfosulfanylethyl]benzene Basic Attributes

Molecular Weight：

261.4 g/mol

Exact Mass：

261.04933569 g/mol

Characteristics

PSA：

91.3 Å²

XLogP3：

2.9061

Melting Point：

208 °C

Toxicity

Name	Type of Test	Exposure Route	Species Observed	Dose/Duration	Toxic Effects	Reference
ACUTE TOXICITY DATA	LD50 - Lethal dose, 50 percent kill	Intraperitoneal	Rodent - mouse	262 mg/kg	Details of toxic effects not reported other than lethal dose value--	Yakugaku Zasshi. Journal of Pharmacy. (Nippon Yakugakkai, 2-12-15 Shibuya, Shibuya-ku, Tokyo 150, Japan) No.1- 1881- Volume(issue)/page/year: 97,1117,1977

Computed Properties

Molecular Weight:261.4
XLogP3:-1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:261.04933569
Monoisotopic Mass:261.04933569
Topological Polar Surface Area:91.3
Heavy Atom Count:16
Complexity:292
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: norephedrine; ammonium carbonate; sodium perborate; ammonium sulfide formula; bromobenzene; toluene chemical formula

Guide of [2-(dimethylamino)-1-sulfosulfanylethyl]benzene

Basic Attributes
Characteristics
Toxicity
Computed Properties

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