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tert-Butyl disulfide

tert-Butyl disulfide structure

CAS No:
110-06-5
Formula:
C8H18S2
Chemical Name:
tert-Butyl disulfide
Synonyms:
Disulfide,bis(1,1-dimethylethyl);tert-Butyl disulfide;Bis(1,1-dimethylethyl) disulfide;Di-tert-butyl disulfide;2,2,5,5-Tetramethyl-3,4-dithiahexane;Bis(tert-butyl)disulfide;NSC 677434;2-(tert-Butyldisulfanyl)-2-methylpropane
Categories:
Chemical Reagents > Organic Reagents

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tert-Butyl disulfide Basic Attributes

Molecular Weight：

178.36

Exact Mass：

178.36

EC Number：

203-734-1

NSC Number：

677434

DSSTox ID：

DTXSID0021913

HScode：

2930909090

Characteristics

PSA：

50.6

XLogP3：

2.9

Appearance：

Clear pale yellow to yellow Liquid

Density：

0.9229 g/cm³ @ Temp: 20 °C

Melting Point：

-5 °C

Boiling Point：

72 °C

Flash Point：

144 °F

Refractive Index：

1.495

Storage Conditions：

2-8°C

Vapor Pressure：

51.7 mm Hg ( 37.7 °C)

Vapor Density：

5 (vs air)

Explosive limit：

0.8%(V)

Safety Information

Packing level：

Ⅲ

Hazard category：

6.1(b)

Transport codes：

UN 3082 9/PG 3

wgk germany：

hazard class code：

51/53-43-36/37/38

safety instructions：

61-37/39-26-24

Marks：

Precautionary statement(s)：

P273

Hazard Statements：

H411

GHS Classification：

|Danger|H227 (18.33%): Combustible liquid [Warning Flammable liquids]|P210, P261, P264, P271, P273, P280, P301+P310, P304+P340, P305+P351+P338, P312, P331, P337+P313, P370+P378, P391, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 60 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

tert-Butyl disulfide Use and Manufacturing

Manufacturing Info：

Disulfide, bis(1,1-dimethylethyl): ACTIVE

Computed Properties

Molecular Weight:178.4
XLogP3:2.9
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:178.08499292
Monoisotopic Mass:178.08499292
Topological Polar Surface Area:50.6
Heavy Atom Count:10
Complexity:80.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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