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5-Methyl-2-thiophenecarboxylic acid

Product Name
5-Methyl-2-thiophenecarboxylic acid
CAS No.
1918-79-2
Chemical Name
5-Methyl-2-thiophenecarboxylic acid
Synonyms
5-METHYLTHIOPHENE-2-CARBOXYLIC ACID;2-Thiophenecarboxylic acid, 5-methyl-;AKOS B000091;TIMTEC-BB SBB004146;RARECHEM AL BE 0181;5-METHYL-2-THENOIC ACID;Rivaroxaban Impurity 51;2-Carboxy-5-methylthiophene;ethyl-2-thiophenecarboxylic acid;5-Methylthiophen-2-carboxylic acid
CBNumber
CB3183843
Molecular Formula
C6H6O2S
Formula Weight
142.18
MOL File
1918-79-2.mol
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5-Methyl-2-thiophenecarboxylic acid Property

Melting point:
135-138 °C(lit.)
Boiling point:
229.75°C (rough estimate)
Density 
1.365 (estimate)
refractive index 
1.5300 (estimate)
storage temp. 
2-8°C(protect from light)
form 
Liquid
pka
3.71±0.10(Predicted)
color 
Clear
BRN 
113857
InChI
InChI=1S/C6H6O2S/c1-4-2-3-5(9-4)6(7)8/h2-3H,1H3,(H,7,8)
InChIKey
VCNGNQLPFHVODE-UHFFFAOYSA-N
SMILES
C1(C(O)=O)SC(C)=CC=1
CAS DataBase Reference
1918-79-2(CAS DataBase Reference)
NIST Chemistry Reference
5-Methyl-2-thiophenecarboxylic acid (keto form)(1918-79-2)
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Safety

Hazard Codes 
Xi
Risk Statements 
36/37/38
Safety Statements 
22-24/25
WGK Germany 
3
HazardClass 
IRRITANT
HS Code 
29309090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P405Store locked up.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
M84429
Product name
5-Methyl-2-thiophenecarboxylic acid
Purity
99%
Packaging
5g
Price
$41.1
Updated
2023/06/20
Sigma-Aldrich
Product number
M84429
Product name
5-Methyl-2-thiophenecarboxylic acid
Purity
99%
Packaging
25g
Price
$255
Updated
2022/05/15
TCI Chemical
Product number
M1118
Product name
5-Methyl-2-thiophenecarboxylic Acid
Purity
>98.0%(GC)(T)
Packaging
5g
Price
$49
Updated
2025/07/31
TRC
Product number
B486023
Product name
5-Methylthiophene-2-carboxylicAcid
Packaging
500mg
Price
$60
Updated
2021/12/16
Frontier Specialty Chemicals
Product number
JK207658
Product name
5-Methyl-2-thiophenecarboxylic Acid
Purity
99%
Packaging
5g
Price
$62
Updated
2021/12/16
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5-Methyl-2-thiophenecarboxylic acid Chemical Properties,Usage,Production

Chemical Properties

BEIGE CRYSTALLINE POWDER

Definition

ChEBI: 5-Methyl-2-thiophenecarboxylic acid is a thiophenecarboxylic acid.

Synthesis Reference(s)

Tetrahedron Letters, 15, p. 2373, 1974 DOI: 10.1016/S0040-4039(01)92259-2

Synthesis

13679-74-8

1918-79-2

GENERAL PROCEDURE: The general procedure for the synthesis of 5-methyl-2-thiophenecarboxylic acid from 2-acetyl-5-methylthiophene was as follows: Oxone (2 eq.) and trifluoroacetic acid (TFA, 2 eq.) were added to a solution of 2-acetyl-5-methylthiophene (100 mg, 1 eq.) in dioxane (5 mL). The reaction mixture was heated to reflux for 10 hours and subsequently cooled to room temperature. Water (10 mL) was added and the mixture was extracted with ethyl acetate (EtOAc, 2 x 20 mL). The organic layers were combined and washed with saturated sodium bicarbonate (NaHCO3) solution. The sodium bicarbonate solution and the aqueous layer were poured onto crushed ice and acidified with 2 M hydrochloric acid (HCl), at which point a colorless solid precipitated. The precipitate was collected by filtration, dried under vacuum and purified by column chromatography (silica gel; ethyl acetate-hexane, 1:9) to give 5-methyl-2-thiophenecarboxylic acid as a white crystalline solid. Yield: 0.096 g (95% based on 2-acetyl-5-methylthiophene); melting point: 122-123 °C.

References

[1] Synthesis (Germany), 2015, vol. 47, # 20, p. 3161 - 3168
[2] Journal of the American Chemical Society, 1947, vol. 69, p. 3096
[3] Recueil des Travaux Chimiques des Pays-Bas, 1949, vol. 68, p. 5,29

5-Methyl-2-thiophenecarboxylic acid Preparation Products And Raw materials

Raw materials

Preparation Products

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5-Methyl-2-thiophenecarboxylic acid Suppliers

TCI AMERICA
Tel
800-4238616
Fax
+1-888-520-1075 / +1-503-283-1987
Email
sales@tciamerica.com
Country
Americas
ProdList
23653
Advantage
75
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View Lastest Price from 5-Methyl-2-thiophenecarboxylic acid manufacturers

Hebei Chuanghai Biotechnology Co,.LTD
Product
5-Methyl-2-thiophenecarboxylic acid 1918-79-2
Price
US $9.00/KG
Min. Order
1KG
Purity
99.8%
Supply Ability
100tons
Release date
2024-08-15
Shanghai kingmorn biotechnology Co.,LTD.
Product
5-Methyl-2-thiophenecarboxylic acid 1918-79-2
Price
US $0.00-0.00/KG
Min. Order
1KG
Purity
98%
Supply Ability
>100KG
Release date
2021-07-20
Zhuozhou Wenxi import and Export Co., Ltd
Product
5-Methyl-2-thiophenecarboxylic acid 1918-79-2
Price
US $15.00-10.00/KG
Min. Order
1KG
Purity
99%+ HPLC
Supply Ability
Monthly supply of 1 ton
Release date
2021-07-11

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