Ethyl 5-(4-chlorophenyl)-5-oxopentanoate

Name: Ethyl 5-(4-chlorophenyl)-5-oxopentanoate
Brand: ChemScene
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CAS No. 54029-03-7
Cat. No. CS-0361578
Purity95+%
MDL No.None

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it.

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*For research and further manufacturing use only, not for direct human use.

Ethyl 5-(4-chlorophenyl)-5-oxopentanoate|CS-0361578

Structure of 54029-03-7

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General Information

CAS No. 54029-03-7
Cat. No. CS-0361578
Purity 95+%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₁₅ClO₃
Molecular Weight 254.71
Synonym(s) Ethyl 5-(4-chlorophenyl)-5-oxovalerate
SMILES CCOC(=O)CCCC(=O)C1=CC=C(C=C1)Cl

Synthesis

Route1
- 108-55-4
- ~%
- 54029-03-7
References
- Angewandte Chemie - International Edition, , vol. 52, # 30 p. 7833 - 7836 Angew. Chem., , vol. 125, # 30 p. 7987 - 7990,4
Route2
- 108-90-7
- ~%
- 54029-03-7
References
- Angewandte Chemie - International Edition, , vol. 52, # 30 p. 7833 - 7836 Angew. Chem., , vol. 125, # 30 p. 7987 - 7990,4
Route3
- 64-17-5
- 36978-49-1
- ~%
- 54029-03-7
References
- Angewandte Chemie - International Edition, , vol. 52, # 30 p. 7833 - 7836 Angew. Chem., , vol. 125, # 30 p. 7987 - 7990,4

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

Quality Control

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Computational Chemistry Data

TPSA 43.37
LogP 3.2561
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 6

Other Classifications

Building Blocks Functional Group Ketone

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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Ethyl 5-(4-chlorophenyl)-5-oxopentanoate

CAS No. 54029-03-7

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