1H-Pyrrole-3-carboxylic acid, 4-(chloromethyl)-1,2,5-trimethyl-, ethyl ester is a complex organic compound with the molecular formula C12H16ClNO2. It is a derivative of pyrrole, a heterocyclic aromatic organic compound containing a nitrogen atom in the ring. The molecule features a pyrrole ring with a carboxylic acid group at the 3-position, a chloromethyl group at the 4-position, and two methyl groups at the 1 and 5 positions. The ethyl ester functional group is attached to the carboxylic acid, making it a derivative of the parent compound. This chemical is primarily used in the synthesis of various pharmaceuticals and agrochemicals due to its unique structure and reactivity.
63050-15-7
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Basic information
- Product Name: 1H-Pyrrole-3-carboxylic acid, 4-(chloromethyl)-1,2,5-trimethyl-, ethyl ester
- Synonyms:
- CAS NO:63050-15-7
- Molecular Formula: C11H16ClNO2
- Molecular Weight: 229.707
- 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-3-carboxylic acid, 4-(chloromethyl)-1,2,5-trimethyl-, ethyl ester(CAS DataBase Reference)
- NIST Chemistry Reference: 1H-Pyrrole-3-carboxylic acid, 4-(chloromethyl)-1,2,5-trimethyl-, ethyl ester(63050-15-7)
- EPA Substance Registry System: 1H-Pyrrole-3-carboxylic acid, 4-(chloromethyl)-1,2,5-trimethyl-, ethyl ester(63050-15-7)
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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: 63050-15-7(Hazardous Substances Data)
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Molecular structure
A derivative of pyrrole with a chloromethyl group at the 4-position, three methyl groups at the 1, 2, and 5-positions, and an ethyl ester group.Aromaticity
The pyrrole ring is an aromatic compound with one nitrogen atom and five carbon atoms.Reactivity
The ethyl ester group and the chloromethyl group make the compound more reactive.Stability
The ethyl ester group contributes to the stability of the compound.Potential applications
The compound may have potential applications in organic synthesis, pharmaceutical research, and material science.Safety precautions
The compound should be handled with care due to its potential reactivity and toxicity.Check Digit Verification of cas no
The CAS Registry Mumber 63050-15-7 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 6,3,0,5 and 0 respectively; the second part has 2 digits, 1 and 5 respectively.Calculate Digit Verification of CAS Registry Number 63050-15:
(7*6)+(6*3)+(5*0)+(4*5)+(3*0)+(2*1)+(1*5)=87
87 % 10 = 7
So 63050-15-7 is a valid CAS Registry Number.
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1H-Pyrrole-3-carboxylic acid, 4-(chloromethyl)-1,2,5-trimethyl-, ethyl
ester
