ChemicalBook > CAS DataBase List > OTAVA-BB BB7118560909

OTAVA-BB BB7118560909

Product Name
OTAVA-BB BB7118560909
CAS No.
3284-47-7
Chemical Name
OTAVA-BB BB7118560909
Synonyms
ethyl 3-methyl-1H-pyrrole-2-carboxylate;AKOS A0602-0540;OTAVA-BB BB7118560909;Ethyl 3-Methyl-1H-pyrrole...;Ethyl 3-Methylpyrrole-2-carboxylate;1H-PYRROLE-2-CARBOXYLIC ACID, 3-METHYL-;Ethyl 3-methyl-1H-pyrrole-2-carboxylate 98%;Pyrrole-2-carboxylic acid, 3-methyl-, ethyl ester;3-Methyl-1H-pyrrole-2-carboxylic acid ethyl ester;1H-PYRROLE-2-CARBOXYLIC ACID, 3-METHYL-, ETHYL ESTER
CBNumber
CB92463811
Molecular Formula
C8H11NO2
Formula Weight
153.18
MOL File
3284-47-7.mol
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OTAVA-BB BB7118560909 Property

Melting point:
56 °C
Boiling point:
270-290 °C
Density 
1.106
storage temp. 
2-8°C
pka
15.54±0.50(Predicted)
Appearance
White to off-white Solid
InChI
InChI=1S/C8H11NO2/c1-3-11-8(10)7-6(2)4-5-9-7/h4-5,9H,3H2,1-2H3
InChIKey
FGILMAYWLMWCQA-UHFFFAOYSA-N
SMILES
N1C=CC(C)=C1C(OCC)=O
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Safety

HS Code 
2933998090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H319Causes serious eye irritation

H332Harmful if inhaled

H335May cause respiratory irritation

Precautionary statements

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

P280Wear protective gloves/protective clothing/eye protection/face protection.

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

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N-Bromosuccinimide Price

TRC
Product number
E926470
Product name
Ethyl3-methyl-1H-pyrrole-2-carboxylate
Packaging
500mg
Price
$90
Updated
2021/12/16
Matrix Scientific
Product number
074519
Product name
Ethyl 3-methyl-1H-pyrrole-2-carboxylate
Purity
95+%
Packaging
1g
Price
$49
Updated
2021/12/16
SynQuest Laboratories
Product number
4H23-1-8B
Product name
Ethyl 3-methyl-1H-pyrrole-2-carboxylate
Packaging
250mg
Price
$60
Updated
2021/12/16
Apolloscientific
Product number
OR313039
Product name
Ethyl3-methyl-1H-pyrrole-2-carboxylate
Purity
98%
Packaging
1g
Price
$109
Updated
2021/12/16
Matrix Scientific
Product number
074519
Product name
Ethyl 3-methyl-1H-pyrrole-2-carboxylate
Purity
95+%
Packaging
5g
Price
$148
Updated
2021/12/16
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OTAVA-BB BB7118560909 Chemical Properties,Usage,Production

Synthesis Reference(s)

Journal of Heterocyclic Chemistry, 28, p. 1671, 1991 DOI: 10.1002/jhet.5570280705
Tetrahedron Letters, 3, p. 921, 1962

Synthesis

3284-52-4

3284-47-7

The general procedure for the synthesis of ethyl 3-hydroxy-3-methyl-1-tosylpyrrolidine-2-carboxylate from ethyl 3-hydroxy-3-methyl-1-tosylpyrrolidine-2-carboxylate was as follows: 3-alkylpyrrole derivatives were prepared according to the procedure described in Scheme 1. First, ethyl glycinate 5 was treated with p-toluenesulfonyl chloride (Ts-Cl) to give intermediate 6. Subsequently, intermediate 6 was reacted in the presence of 4-diethylaminobutan-2-one and potassium tert-butanolate (t-BuOK) to produce intermediate 7. Next, intermediate 7 was dehydrated with phosphorus oxychloride (POCl3) to give dihydropyrrole derivative 8. In the presence of sodium ethanolate, the dihydropyrrole derivative was synthesized by an elimination reaction the dihydropyrrole derivative 8 was converted to pyrrole derivative 9. Then, the pyrrole nitrogen was deprotonated using sodium hydride (NaH) and an alkylation reaction was carried out to obtain intermediate 10. finally, the ester group was hydrolyzed by potassium hydroxide (KOH) in aqueous solution in methanol (MeOH), followed by the use of 1-ethyl-3-(3-dimethylaminopropyl) carbodiimide (EDCI) to convert the corresponding acid 11 into the target amide products (81), (82) and (83).

References

[1] Patent: WO2009/23272, 2009, A1. Location in patent: Page/Page column 36
[2] Journal of Heterocyclic Chemistry, 1991, vol. 28, # 7, p. 1671 - 1676
[3] Patent: EP2612848, 2013, A1
[4] Patent: WO2009/117421, 2009, A2

OTAVA-BB BB7118560909 Preparation Products And Raw materials

Raw materials

Preparation Products

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OTAVA-BB BB7118560909 Suppliers

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View Lastest Price from OTAVA-BB BB7118560909 manufacturers

Shaanxi Dideu Medichem Co. Ltd
Product
OTAVA-BB BB7118560909 3284-47-7
Price
US $1.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
20T
Release date
2024-07-11
Career Henan Chemical Co
Product
Ethyl 3-methyl-1H-pyrrole-2-carboxylate 3284-47-7
Price
US $8.80/KG
Min. Order
1KG
Purity
97%-99%
Supply Ability
100kg
Release date
2019-08-05