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1-Benzothiophene-3-carboxylicacid

1-Benzothiophene-3-carboxylicacid structure

CAS No:
5381-25-9
Formula:
C9H6O2S
Chemical Name:
1-Benzothiophene-3-carboxylicacid
Synonyms:
3-Acid;AKOSB007499;ART-CHEM-BBB007499;TIMTEC-BBSBB007035;RARECHEMALBE0712;3-benzothiophenecarboxylicacid;3-CARBOXYLICACIDBENZOTHIOPHENE;BENZOTHIOPHENE-3-CARBOXYLICACID;Benzobüthiophene-3-carboxylicacid;1-BENZOTHIOPHENE-3-CARBOXYLICACID

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Description

White solid

1-Benzothiophene-3-carboxylicacid Basic Attributes

Molecular Weight：

178.21

Exact Mass：

178.008850

DSSTox ID：

DTXSID50345034

HScode：

2934999090

Characteristics

PSA：

65.5

XLogP3：

2.6

Density：

1.4±0.1 g/cm3

Melting Point：

174 °C

Boiling Point：

376.2°C at 760 mmHg

Flash Point：

181.3±20.4 °C

Refractive Index：

1.717

Safety Information

Hazard category：

IRRITANT

hazard class code：

36/37/38

safety instructions：

26-37/39

Marks：

Hazard note：

Irritant

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

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 8 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:178.21
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:178.00885060
Monoisotopic Mass:178.00885060
Topological Polar Surface Area:65.5
Heavy Atom Count:12
Complexity:193
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Pyridine

Carbon dioxide

Sodium acetate trihydrate

Acetic acid

Methanol

Sulfuric acid

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1-Benzothiophene-3-carboxylic acid

CAS No.: 5381-25-9

Content: 99.00%

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Guide of 1-Benzothiophene-3-carboxylicacid

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
Material
Recommended Suppliers

1-Benzothiophene-3-carboxylicacid

SDS

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