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Thiofanox sulfoxide

Thiofanox sulfoxide structure

CAS No:
39184-27-5
Formula:
C9H18N2O3S
Chemical Name:
Thiofanox sulfoxide
Synonyms:
2-Butanone,3,3-dimethyl-1-(methylsulfinyl)-,O-[(methylamino)carbonyl]oxime;3,3-Dimethyl-1-(methylsulfinyl)-2-butanone O-[(methylamino)carbonyl]oxime;Thiofanox sulfoxide
Categories:
Chemical Reagents > Organic Reagents

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Thiofanox sulfoxide Basic Attributes

Molecular Weight：

234.318

Exact Mass：

234.32

Characteristics

PSA：

86.97000

XLogP3：

2.37960

Density：

1.16g/cm3

Refractive Index：

1.516

Storage Conditions：

2-8°C

Safety Information

Transport codes：

UN28116.1/PG1

wgk germany：

hazard class code：

24-28

safety instructions：

28-36/37-45

RTECS Number：

EL8170000

Marks：

T+

Precautionary statement(s)：

P264-P280-P301 + P310-P302 + P350-P310

Hazard Statements：

H300 + H310

GHS Classification：

|Danger|H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]|P262, P264, P270, P280, P301+P310, P302+P350, P310, P321, P322, P330, P361, P363, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:234.32
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:234.10381361
Monoisotopic Mass:234.10381361
Topological Polar Surface Area:87
Heavy Atom Count:15
Complexity:282
Undefined Atom Stereocenter Count:1
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes