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6-methyl-2-sulfanylidene-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile

6-methyl-2-sulfanylidene-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile structure

CAS No:
182127-92-0
Formula:
C8H5F3N2S
Chemical Name:
6-methyl-2-sulfanylidene-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile

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6-methyl-2-sulfanylidene-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile Basic Attributes

Molecular Weight：

218.19900

Exact Mass：

218.01255383 g/mol

DSSTox ID：

DTXSID10351373

HScode：

2933399090

Characteristics

PSA：

75.48000

XLogP3：

2.56918

Density：

1.44g/cm3

Melting Point：

200ºC

Boiling Point：

204.4ºC at 760mmHg

Flash Point：

77.4ºC

Refractive Index：

1.536

Vapor Pressure：

0.263mmHg at 25°C

Safety Information

hazard class code：

R20/21/22

safety instructions：

S36/37

Marks：

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:218.20
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Exact Mass:218.01255383
Monoisotopic Mass:218.01255383
Topological Polar Surface Area:67.9
Heavy Atom Count:14
Complexity:395
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-methyl-2-sulfanylidene-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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