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3-Methylbenzofuran-2-carboxylicacid

3-Methylbenzofuran-2-carboxylicacid structure

CAS No:
24673-56-1
Formula:
C10H8O3
Chemical Name:
3-Methylbenzofuran-2-carboxylicacid
Synonyms:
ART-CHEM-BB B013963;AURORA 22060;OTAVA-BB BB7216516554;TIMTEC-BB SBB003779;AKOS BBS-00007903;AKOS BC-3053;AKOS B013963;3-METHYLBENZOFURAN-2-CARBOXYLIC ACID
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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3-Methylbenzofuran-2-carboxylicacid Basic Attributes

Molecular Weight：

176.17

Exact Mass：

176.047344113 g/mol

DSSTox ID：

DTXSID80344939

HScode：

2932999099

Characteristics

PSA：

50.44000

XLogP3：

2.43940

Appearance：

Whiteless powder

Density：

1.303±0.06 g/cm3

Melting Point：

194-197 °C (lit.)

Boiling Point：

328.7±22.0 °C(Predicted)

Flash Point：

152.6ºC

Vapor Pressure：

7.53E-05mmHg at 25°C

PKA：

2.87±0.30

Safety Information

Hazard category：

IRRITANT

wgk germany：

hazard class code：

R36/37/38

safety instructions：

24/25

Marks：

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

3-Methylbenzofuran-2-carboxylicacid Use and Manufacturing

3-Methylbenzofuran-2-carboxylic Acid is a benzofuran based acid used in the preparation of matrix metalloproteinase (MMP) inhibitors for the treatment of osteoarthritis.

Computed Properties

Molecular Weight:176.17
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:176.047344113
Monoisotopic Mass:176.047344113
Topological Polar Surface Area:50.4
Heavy Atom Count:13
Complexity:214
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Latest News on 3-Methylbenzofuran-2-carboxylicacid

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Guide of 3-Methylbenzofuran-2-carboxylicacid

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

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