Ethyl 5-(2-cyanoacetyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

Name: Ethyl 5-(2-cyanoacetyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
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CAS No. 303126-23-0
Cat. No. CS-0218609
Molecule weight234.25
Purity≥97%
MDL No.None

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Ethyl 5-(2-cyanoacetyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate|CS-0218609

Structure of 303126-23-0

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General Information

CAS No. 303126-23-0
Cat. No. CS-0218609
Purity ≥97%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₂H₁₄N₂O₃
Molecular Weight 234.25
Synonym(s) 1H-Pyrrole-3-carboxylicacid,5-(cyanoacetyl)-2,4-dimethyl-,ethylester(9CI)
SMILES CCOC(=O)C1=C(C)NC(=C1C)C(=O)CC#N

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 82.95
LogP 1.90462
H_Acceptors 4
H_Donors 1
Rotatable_Bonds 4

Other Classifications

Building Blocks Functional Group Ketone

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Pyrrole compounds

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Ethyl 5-(2-cyanoacetyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

CAS No. 303126-23-0

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