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4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE

4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE structure

CAS No:
16097-63-5
Formula:
C6H4ClF3N2S
Chemical Name:
4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE
Synonyms:
SPECS AG-996/31082064;BUTTPARK 6\01-56;4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE;4-CHLORO-2-METHYLTHIO-6-(TRIFLUOROMETHYL)PYRIMIDINE;4-Chloro-2-(methylthio)-6-(trifluoromethyl)pyrimidine ,97%;4-Chloro-2-(Methylsulfanyl)-6-(trifluoroMethyl)pyriMidine (en);4-Chloro-2-(methylsulphanyl)-6-(trifluoromethyl)pyrimidine, 4-Chloro-2-(methylsulphanyl)-6-(trifluoromethyl)-1,3-diazine;NSC 64344
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

Colorless liquid

4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE Basic Attributes

Molecular Weight：

228.62

Exact Mass：

227.973587

NSC Number：

64344

DSSTox ID：

DTXSID20289799

HScode：

29335990

Characteristics

PSA：

51.1

XLogP3：

2.9

Appearance：

Colorless Liquid

Density：

1.52±0.1 g/cm3(Predicted)

Melting Point：

38-39℃ (ethyl acetateligroine )

Boiling Point：

83.5℃ (9.3 Torr)

Flash Point：

97.6±25.9 °C

Refractive Index：

1.5050 (25℃)

Vapor Pressure：

0.0676mmHg at 25°C

Safety Information

Hazard category：

IRRITANT

hazard class code：

36/37/38-25

safety instructions：

26-36/37/39-45

Marks：

Xi,T

Hazard note：

Irritant/Stench

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:228.62
XLogP3:2.9
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:227.9735815
Monoisotopic Mass:227.9735815
Topological Polar Surface Area:51.1
Heavy Atom Count:13
Complexity:178
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
Learn More Other Chemicals

4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE

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