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1-Tosylpyrrole

1-Tosylpyrrole structure

CAS No:
17639-64-4
Formula:
C11H11NO2S
Chemical Name:
1-Tosylpyrrole
Synonyms:
1H-Pyrrole,1-[(4-methylphenyl)sulfonyl]-;Pyrrole,1-(p-tolylsulfonyl)-;1-[(4-Methylphenyl)sulfonyl]-1H-pyrrole;1-(p-Tolylsulfonyl)pyrrole;1-(p-Tolylsulfonyl)-1H-pyrrole;N-Tosylpyrrole;1-Tosylpyrrole;1-(4-Methylphenylsulfonyl)pyrrole;1-[(4-Methylphenyl)sulfonyl]-1H-pyrrole;1-(p-Toluenesulfonyl)-1H-pyrrole;N-p-Toluenesulfonylpyrrole;1-(p-Tosyl)-1H-pyrrole;1-(4-Methylbenzenesulfonyl)-1H-pyrrole;1-(Toluene-4-sulfonyl)-1H-pyrrole;1-Tosyl-1H-pyrrole

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1-Tosylpyrrole Basic Attributes

Molecular Weight：

221.28

Exact Mass：

221.28

EC Number：

200-258-5

DSSTox ID：

DTXSID80348694

HScode：

2933990090

Characteristics

PSA：

47.45000

XLogP3：

3.11430

Appearance：

BEIGE TO LIGHT BROWN CRYSTALLINE POWDER

Density：

1.21

Melting Point：

134 °C

Boiling Point：

377.3±35.0 °C(Predicted)

Flash Point：

182ºC

Refractive Index：

1.4790 (estimate)

Vapor Pressure：

3.71E-05mmHg at 25°C

PKA：

-8.34±0.70

Safety Information

wgk germany：

hazard class code：

36/37/38

safety instructions：

24/25-36-26

Marks：

Precautionary statement(s)：

P261; P305 + P351 + P338

Hazard Statements：

H315; H319; H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:221.28
XLogP3:2.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:221.05104977
Monoisotopic Mass:221.05104977
Topological Polar Surface Area:47.4
Heavy Atom Count:15
Complexity:293
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-Tosylpyrrole

Basic Attributes
Characteristics
Safety Information
Computed Properties

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