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METHYL 3-CHLOROBENZO[B]THIOPHENE-2-CARBOXYLATE

METHYL 3-CHLOROBENZO[B]THIOPHENE-2-CARBOXYLATE structure

CAS No:
21211-07-4
Formula:
C10H7ClO2S
Chemical Name:
METHYL 3-CHLOROBENZO[B]THIOPHENE-2-CARBOXYLATE
Synonyms:
BUTTPARK 96\04-81;METHYL 3-CHLORO-2-BENZO[B]-THIOPHENE CARBOXYLATE;METHYL 3-CHLOROBENZO[B]THIOPHENE-2-CARBOXYLATE;AKOS AU36-M327;3-Chlorobenzo[b]thiophene-2-carboxylic acid methyl ester;Methylchlorobenzobthiophenecarboxylate;METHYL 3-CHLOROBENZO(B)THIOPHENE-2-CARB&;Methyl 3-chlorobenzobüthiophene-2-carboxylate
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

White solid

METHYL 3-CHLOROBENZO[B]THIOPHENE-2-CARBOXYLATE Basic Attributes

Molecular Weight：

226.68

Exact Mass：

225.98600

BRN：

1312686

DSSTox ID：

DTXSID90345790

HScode：

2934999090

Characteristics

PSA：

54.5

XLogP3：

3.34130

Density：

1.391 g/cm3

Melting Point：

80-84 °C(lit.)

Boiling Point：

338.8ºC at 760 mmHg

Flash Point：

158.7ºC

Refractive Index：

1.646

Vapor Pressure：

9.6E-05mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

safety instructions：

24/25

Marks：

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:226.68
XLogP3:3.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:225.9855283
Monoisotopic Mass:225.9855283
Topological Polar Surface Area:54.5
Heavy Atom Count:14
Complexity:234
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of METHYL 3-CHLOROBENZO[B]THIOPHENE-2-CARBOXYLATE

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

METHYL 3-CHLOROBENZO[B]THIOPHENE-2-CARBOXYLATE

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