Linagliptin methyldimer

CAS No. 1418133-47-7
Cat. No. CS-0790540
Molecule weight945.08
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+

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

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General Information
Safety Information
Quality Control
Computational Chemistry Data

General Information

CAS No. 1418133-47-7
Cat. No. CS-0790540
Purity ≥95%
MDL No. None
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₅₀H₅₆N₁₆O₄
Molecular Weight 945.08
Synonym(s) None
SMILES O=C(N(C1=C(C2=O)N(C(N3C[C@@H](CCC3)N)=N1)CC#CC)C)N2CC4=NC(CC5(N=C(NC6=C5C=CC=C6)CN7C(N(C8=C(C7=O)N(C(N9C[C@@H](CCC9)N)=N8)CC#CC)C)=O)C)=C%10C=CC=CC%10=N4

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 232.33
LogP 1.982
H_Acceptors 20
H_Donors 3
Rotatable_Bonds 10

Other Classifications

Building Blocks Functional Group Amine

Building Blocks Functional Group Alkyne

Building Blocks Skeleton Aromatic heterocycle compounds Quinazoline compounds

Building Blocks Skeleton Aromatic heterocycle compounds Purine compounds

Building Blocks Skeleton Aromatic heterocycle compounds Other aromatic heterocycles compounds

Building Blocks Skeleton Aliphatic heterocycle compounds Piperidine compounds

Building Blocks Skeleton Chiral compounds Chiral Building Blocks

Life Science Click Chemistry Reagents Alkyne

Chemical Biology Pharmaceutical Development and Drug Discovery Research Conjugation Chemistry/Click Chemistry Terminal Alkynes

Chemical Biology Conjugation Chemistry/Click Chemistry Terminal Alkynes

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Linagliptin methyldimer

CAS No. 1418133-47-7