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1,3,5-Trimethyl-1H-pyrazole-4-sulfonyl chloride

1,3,5-Trimethyl-1H-pyrazole-4-sulfonyl chloride structure

CAS No:
59340-27-1
Formula:
C6H9ClN2O2S
Chemical Name:
1,3,5-Trimethyl-1H-pyrazole-4-sulfonyl chloride
Synonyms:
1H-Pyrazole-4-sulfonyl chloride,1,3,5-trimethyl-;Pyrazole-4-sulfonyl chloride,1,3,5-trimethyl-;1,3,5-Trimethyl-1H-pyrazole-4-sulfonyl chloride;1,3,5-Trimethyl-4-pyrazolesulfonyl chloride

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1,3,5-Trimethyl-1H-pyrazole-4-sulfonyl chloride Basic Attributes

Molecular Weight：

208.67

Exact Mass：

208.67

DSSTox ID：

DTXSID30372000

HScode：

2933199090

Characteristics

PSA：

60.34000

XLogP3：

2.04520

Density：

1.45±0.1 g/cm3

Melting Point：

39 °C

Boiling Point：

312.4±42.0 °C(Predicted)

Flash Point：

142.7ºC

Refractive Index：

1.592

PKA：

-2.29±0.10

Safety Information

Hazard category：

IRRITANT

Transport codes：

3261

hazard class code：

safety instructions：

26-36/37/39

Marks：

GHS Classification：

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P261, P264, P271, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:208.67
XLogP3:1.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:208.0073264
Monoisotopic Mass:208.0073264
Topological Polar Surface Area:60.3
Heavy Atom Count:12
Complexity:261
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,3,5-Trimethyl-1H-pyrazole-4-sulfonyl chloride

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

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