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3-(Bromomethyl)-5-chlorobenzo[b]thiophene

3-(Bromomethyl)-5-chlorobenzo[b]thiophene structure

CAS No:
1198-51-2
Formula:
C9H6BrClS
Chemical Name:
3-(Bromomethyl)-5-chlorobenzo[b]thiophene
Synonyms:
3-(Bromomethyl)-5-chlorobenzo[b]thiophene;3-(Bromomethyl)-5-chloro-1-benzothiophene;3-(bromomethyl)-5-chloro benzo[b]thiophene;Benzo[b]thiophene, 3-(bromomethyl)-5-chloro-;3-(bromomethyl)-5-chlorobenzothiophene;3-Bromomethyl-5-chlorobenzo[b]thiophene;5-chloro-3-bromomethylbenzothiophene;5-chloro-3-bromomethyl-benzo[b]-thiophene;3-(bromomethyl)-5-chlorobenzo(b)thiophene;dequaliniumchloride
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

White to off-white solid

3-(Bromomethyl)-5-chlorobenzo[b]thiophene Basic Attributes

Molecular Weight：

261.57

Exact Mass：

259.906189

DSSTox ID：

DTXSID90381577

HScode：

29349990

Characteristics

PSA：

28.2

XLogP3：

5.68

Density：

1.693±0.06 g/cm3(Predicted)

Melting Point：

129 °C

Boiling Point：

345.5±27.0 °C(Predicted)

Flash Point：

162.8±23.7 °C

Refractive Index：

1.705

Storage Conditions：

0-10°C

Safety Information

Packing level：

III

Hazard category：

Transport codes：

3261

hazard class code：

36/37/38-34

safety instructions：

26-36/37/39-45-3

Marks：

Hazard note：

Corrosive

Precautionary statement(s)：

P234, 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, P332+P313, P337+P313, P362, P363, P390, P403+P233, P404, P405, P501

Hazard Statements：

H290

GHS Classification：

|Danger|H290 (33.33%): May be corrosive to metals [Warning Corrosive to Metals]|P234, 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, P332+P313, P337+P313, P362, P363, P390, P403+P233, P404, P405, and P501|Aggregated GHS information provided by 3 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:261.57
XLogP3:4.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:259.90621
Monoisotopic Mass:259.90621
Topological Polar Surface Area:28.2
Heavy Atom Count:12
Complexity:165
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Chlorobenzene

Sodium hydroxide

Carbon tetrachloride

Acetic acid

Acetone

Benzene

Sulfuric acid

Polyphosphoric acids

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CAS No.: 1198-51-2

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3-(Bromomethyl)-5-chlorobenzo[b]thiophene (Cas no. 1198-51-2)

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CAS No.: 1198-51-2

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Guide of 3-(Bromomethyl)-5-chlorobenzo[b]thiophene

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
Material
Recommended Suppliers
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3-(Bromomethyl)-5-chlorobenzo[b]thiophene

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