N-[(2E)-3-(2-Fluorophenyl)-1-oxo-2-propen-1-yl]-β-alanine

Name: N-[(2E)-3-(2-Fluorophenyl)-1-oxo-2-propen-1-yl]-β-alanine
Brand: ChemScene
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CAS No. 1616611-70-1
Cat. No. CS-0782091
Molecule weight237.23
Purity≥98%
MDL No.None

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Excepted Quantity	$0.00
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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N-[(2E)-3-(2-Fluorophenyl)-1-oxo-2-propen-1-yl]-β-alanine|CS-0782091

Structure of 1616611-70-1

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General Information

CAS No. 1616611-70-1
Cat. No. CS-0782091
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₂H₁₂FNO₃
Molecular Weight 237.23
Synonym(s) None
SMILES OC(CCNC(/C=C/C1=C(C=CC=C1)F)=O)=O

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 66.4
LogP 1.4298
H_Acceptors 2
H_Donors 2
Rotatable_Bonds 5

Other Classifications

Building Blocks Functional Group Carboxylic Acid

Building Blocks Functional Group Olefins

Building Blocks Functional Group Amide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Life Science Amino Acids and their Derivatives Alanine and derivatives

Chemical Biology Peptide Chemistry Amino Acid Derivatives

Key Words

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N-[(2E)-3-(2-Fluorophenyl)-1-oxo-2-propen-1-yl]-β-alanine

CAS No. 1616611-70-1

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