1H-Pyrrole-2-carboxylic acid, 5-(3-amino-1-oxo-2-butenyl)-4-[1-(phenylmethyl)-2-thioxo-3-pyrrolidinyl]-, ethyl ester is a complex organic compound with a molecular formula of C21H22N2O4S. It is a derivative of pyrrole-2-carboxylic acid, featuring a 3-amino-1-oxo-2-butenyl group at the 5-position and a phenylmethyl-2-thioxo-3-pyrrolidinyl group at the 4-position. The ethyl ester functional group is attached to the carboxylic acid moiety, making it a member of the ester class. 1H-Pyrrole-2-carboxylic acid,
5-(3-amino-1-oxo-2-butenyl)-4-[1-(phenylmethyl)-2-thioxo-3-pyrrolidinyl]-
, ethyl ester is characterized by its unique structure, which includes a pyrrole ring, an amide linkage, and a thioamide group, and it may have potential applications in pharmaceuticals or as a chemical intermediate due to its diverse functional groups and structural features.
94405-20-6
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Basic information
- Product Name: 1H-Pyrrole-2-carboxylic acid, 5-(3-amino-1-oxo-2-butenyl)-4-[1-(phenylmethyl)-2-thioxo-3-pyrrolidinyl]- , ethyl ester
- Synonyms:
- CAS NO:94405-20-6
- Molecular Formula: C22H25N3O3S
- Molecular Weight: 411.525
- EINECS: N/A
- Product Categories: N/A
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Chemical Properties
- Melting Point: N/A
- Boiling Point: N/A
- Flash Point: N/A
- Appearance: N/A
- Density: N/A
- Refractive Index: N/A
- Storage Temp.: N/A
- Solubility: N/A
- CAS DataBase Reference: 1H-Pyrrole-2-carboxylic acid, 5-(3-amino-1-oxo-2-butenyl)-4-[1-(phenylmethyl)-2-thioxo-3-pyrrolidinyl]- , ethyl ester(CAS DataBase Reference)
- NIST Chemistry Reference: 1H-Pyrrole-2-carboxylic acid, 5-(3-amino-1-oxo-2-butenyl)-4-[1-(phenylmethyl)-2-thioxo-3-pyrrolidinyl]- , ethyl ester(94405-20-6)
- EPA Substance Registry System: 1H-Pyrrole-2-carboxylic acid, 5-(3-amino-1-oxo-2-butenyl)-4-[1-(phenylmethyl)-2-thioxo-3-pyrrolidinyl]- , ethyl ester(94405-20-6)
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Safety Data
- Hazard Codes: N/A
- Statements: N/A
- Safety Statements: N/A
- WGK Germany:
- RTECS:
- HazardClass: N/A
- PackingGroup: N/A
- Hazardous Substances Data: 94405-20-6(Hazardous Substances Data)
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Check Digit Verification of cas no
The CAS Registry Mumber 94405-20-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 9,4,4,0 and 5 respectively; the second part has 2 digits, 2 and 0 respectively.Calculate Digit Verification of CAS Registry Number 94405-20:
(7*9)+(6*4)+(5*4)+(4*0)+(3*5)+(2*2)+(1*0)=126
126 % 10 = 6
So 94405-20-6 is a valid CAS Registry Number.
94405-20-6Upstream product
- 22441-25-4 1-(1H-pyrrol-2-yl)butane-1,3-dione
- 94405-06-8 2-(3-methylisoxazol-5-yl)pyrrole
- 94405-12-6 ethyl 4-(1-benzyl-3-hydroxy-2-oxopyrrolidin-3-yl)-5-(3-methylisoxazol-5-yl)pyrrole-2-carboxylate
- 94405-18-2 ethyl 4-(1-benzyl-2-oxopyrrolidin-3-yl)-5-(3-methylisoxazol-5-yl)pyrrole-2-carboxylate
- 94405-16-0 ethyl 4-(1-benzyl-2-oxopyrrolidin-3-yl)-5-(3-amino-1-oxo-2-butenyl)pyrrole-2-carboxylate
- 94405-13-7 ethyl 4-(1-benzyl-2-oxo-Δ3-pyrrolidin-3-yl)-5-(3-methylisoxazol-5-yl)pyrrole-2-carboxylate
- 94405-08-0 2-(3-methylisoxazol-5-yl)-5-(trichloroacetyl)pyrrole
- 94405-07-9 1-(1H-Pyrrol-2-yl)-butane-1,3-dione 3-oxime
- 94405-10-4 ethyl 4-bromo-5-(3-methylisoxazol-5-yl)pyrrole-2-carboxylate
- 94405-09-1 ethyl 5-(3-methylisoxazol-5-yl)pyrrole-2-carboxylate
- 94405-19-3 ethyl 4-(1-benzyl-2-thioxopyrrolidin-3-yl)-5-(3-methylisoxazol-5-yl)pyrrole-2-carboxylate
94405-20-6Downstream Products
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1H-Pyrrole-2-carboxylic acid,
5-(3-amino-1-oxo-2-butenyl)-4-[1-(phenylmethyl)-2-thioxo-3-pyrrolidinyl]-
, ethyl ester
