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3-METHYLBENZO[B]THIOPHENE-2-CARBOXALDEHYDE

3-METHYLBENZO[B]THIOPHENE-2-CARBOXALDEHYDE structure

CAS No:
22053-74-3
Formula:
C10H8OS
Chemical Name:
3-METHYLBENZO[B]THIOPHENE-2-CARBOXALDEHYDE
Synonyms:
2-ForMyl-3-Methylbenzo[b]thiophene;3-Methyl-1-benzothiophene-2-carboxaldehyde;3-Methyl-1-benzothiophene-2-carbaldehyde;BUTTPARK 82\04-76;3-METHYLBENZO[B]THIOPHENE-2-CARBALDEHYDE;3-METHYLBENZO[B]THIOPHENE-2-CARBOXALDEHYDE;3-METHYLBENZOTHIOPHENE-2-CARBALDEHYDE;3-Methylthianaphthene-2-carboxaldehyde
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

white to light yellow crystal powder

3-METHYLBENZO[B]THIOPHENE-2-CARBOXALDEHYDE Basic Attributes

Molecular Weight：

176.23

Exact Mass：

176.03000

BRN：

121582

DSSTox ID：

DTXSID20334192

HScode：

2934999090

Characteristics

PSA：

45.3

XLogP3：

3.1

Appearance：

white to light yellow crystal powder

Density：

1.25g/cm3

Melting Point：

88-90°C

Boiling Point：

318.9ºC at 760 mmHg

Flash Point：

146.7ºC

Refractive Index：

1.692

Storage Conditions：

Keep Cold

Vapor Pressure：

0.00035mmHg at 25°C

Safety Information

Hazard category：

IRRITANT, AIR SENSITIVE, KEEP COLD

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

24/25-36/37/39

Marks：

Hazard note：

Harmful

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 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

3-METHYLBENZO[B]THIOPHENE-2-CARBOXALDEHYDE Use and Manufacturing

Benzothiophene derivatives are GluR6 antagonists useful for the treatment of disorders of the central nervous system.

Computed Properties

Molecular Weight:176.24
XLogP3:3.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:176.02958605
Monoisotopic Mass:176.02958605
Topological Polar Surface Area:45.3
Heavy Atom Count:12
Complexity:181
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-METHYLBENZO[B]THIOPHENE-2-CARBOXALDEHYDE

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

3-METHYLBENZO[B]THIOPHENE-2-CARBOXALDEHYDE

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