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3,5-Bis(trifluoromethyl)phenyl isothio...

3,5-Bis(trifluoromethyl)phenyl isothio... structure

CAS No:
23165-29-9
Formula:
C9H3F6NS
Chemical Name:
3,5-Bis(trifluoromethyl)phenyl isothio...
Categories:
Chemical Reagents > Organic Reagents

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Description

CLEAR YELLOW LIQUID

3,5-Bis(trifluoromethyl)phenyl isothio... Basic Attributes

Molecular Weight：

271.18

Exact Mass：

270.989044

BRN：

2990816

EC Number：

-0

DSSTox ID：

DTXSID10369892

HScode：

2930909090

Characteristics

PSA：

44.45000

XLogP3：

6.26

Appearance：

Clear yellow Liquid

Density：

1.4±0.1 g/cm3

Melting Point：

160℃

Boiling Point：

63 °C1.5 mm Hg(lit.)

Flash Point：

228 °F

Refractive Index：

1.459

Water Solubility：

Hydrolyzes in water.

Vapor Pressure：

0.116mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

2810

wgk germany：

hazard class code：

safety instructions：

22-26-27-36/37/39-45

Marks：

C,T,Xi

Hazard note：

Toxic

Precautionary statement(s)：

P280-P301 + P310 + P330-P304 + P340 + P312-P305 + P351 + P338-P337 + P313

Hazard Statements：

H301-H315-H319-H335

GHS Classification：

|Danger|H302 (16.67%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P363, P405, and P501|Aggregated GHS information provided by 48 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:271.18
XLogP3:5.7
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:1
Exact Mass:270.98903925
Monoisotopic Mass:270.98903925
Topological Polar Surface Area:44.4
Heavy Atom Count:17
Complexity:294
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,5-Bis(trifluoromethyl)phenyl isothio...

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
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3,5-Bis(trifluoromethyl)phenyl isothio...

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