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

Name: Ethyl 4-(2-ethoxy-2-oxoethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
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CAS No. 40345-42-4
Cat. No. CS-1090186
Purity≥95%
MDL No.None

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Ethyl 4-(2-ethoxy-2-oxoethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate|CS-1090186

Structure of 40345-42-4

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General Information

CAS No. 40345-42-4
Cat. No. CS-1090186
Purity ≥95%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₁₉NO₄
Molecular Weight 253.29
Synonym(s) None
SMILES O=C(OCC)C=1NC(=C(C1C)CC(=O)OCC)C

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 68.39
LogP 1.91384
H_Acceptors 4
H_Donors 1
Rotatable_Bonds 5

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Pyrrole compounds

Key Words

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

CAS No. 40345-42-4

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