Benzyl (2S,4S)-2-cyano-4-fluoropyrrolidine-1-carboxylate

Name: Benzyl (2S,4S)-2-cyano-4-fluoropyrrolidine-1-carboxylate
Brand: ChemScene
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CAS No. 518047-78-4
Cat. No. CS-0453203
Molecule weight248.25
Purity≥98%
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+

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Benzyl (2S,4S)-2-cyano-4-fluoropyrrolidine-1-carboxylate|CS-0453203

Structure of 518047-78-4

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General Information

CAS No. 518047-78-4
Cat. No. CS-0453203
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₁₃FN₂O₂
Molecular Weight 248.25
Synonym(s) Z-CIS-4-FLUORO-L-PROLINONITRILE
SMILES C1=CC=C(C=C1)COC(=O)N2C[C@H](C[C@H]2C#N)F

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 53.33
LogP 2.25918
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Functional Group Ester

Building Blocks Skeleton Aliphatic heterocycle compounds Pyrrolidine compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Building Blocks Skeleton Chiral compounds Chiral Building Blocks

Key Words

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Benzyl (2S,4S)-2-cyano-4-fluoropyrrolidine-1-carboxylate

CAS No. 518047-78-4

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