5'-Benzyl 1-(tert-butyl) (3a'S,6a'R)-3'-oxohexahydro-5'H-spiro[piperidine-4,1'-pyrrolo[3,4-c]pyrrole]-1,5'-dicarboxylate

Name: 5'-Benzyl 1-(tert-butyl) (3a'S,6a'R)-3'-oxohexahydro-5'H-spiro[piperidine-4,1'-pyrrolo[3,4-c]pyrrole]-1,5'-dicarboxylate
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CAS No. 1268519-36-3
Cat. No. CS-0036716
Purity≥95%
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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5'-Benzyl 1-(tert-butyl) (3a'S,6a'R)-3'-oxohexahydro-5'H-spiro[piperidine-4,1'-pyrrolo[3,4-c]pyrrole]-1,5'-dicarboxylate|CS-0036716

Structure of 1268519-36-3

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General Information
Safety Information
Quality Control
Computational Chemistry Data

General Information

CAS No. 1268519-36-3
Cat. No. CS-0036716
Purity ≥95%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₂₃H₃₁N₃O₅
Molecular Weight 429.51
Synonym(s) Racemic-(3a'S,6a'R)-5'-benzyl 1-tert-butyl 3'-oxotetrahydro-2'H-spiro[piperidine-4,1'-pyrrolo[3,4-c]pyrrole]-1,5'(3'H)-dicarboxylate
SMILES CC(C)(C)OC(=O)N1CCC2(CC1)[C@H]3CN(C[C@H]3C(=N2)O)C(=O)OCC4=CC=CC=C4

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 91.67
LogP 3.611
H_Acceptors 5
H_Donors 1
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Alcohol

Building Blocks Functional Group Ester

Building Blocks Skeleton Aliphatic heterocycle compounds Pyrrolidine compounds

Building Blocks Skeleton Aliphatic heterocycle compounds Piperidine compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Building Blocks Skeleton Chiral compounds Chiral Building Blocks

Building Blocks Skeleton Spirol Rings compounds

Key Words

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5'-Benzyl 1-(tert-butyl) (3a'S,6a'R)-3'-oxohexahydro-5'H-spiro[piperidine-4,1'-pyrrolo[3,4-c]pyrrole]-1,5'-dicarboxylate

CAS No. 1268519-36-3