Product Code

TRC-P580510

CAS Number

2731552-40-0

Product Format

Neat

Molecular Formula

C46H84N12 • HCl

Molecular Weight

841.7

Product Categories

TRC

Alternate CAS Number

Free Base: 2731552-39-7

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Plerixafor N-1-(4-Methylbenzyl)-1,4,8,11-tetraazacyclotetradecane Hydrochloride

CAS Number

2731552-40-0

Molecular Formula

C46H84N12 • HCl

Molecular Weight

841.7

Accurate Mass

840.67

SMILES

N1(CC2=CC=C(CN3CCNCCCNCCNCCC3)C=C2)CCN(CC4=CC=C(CN5CCNCCCNCCNCCC5)C=C4)CCCNCCNCCC1.Cl

InChI

InChI=1S/C46H84N12.ClH/c1-15-47-23-25-49-19-3-31-55(35-29-53-17-1)39-43-7-11-45(12-8-43)41-57-33-5-21-51-27-28-52-22-6-34-58(38-37-57)42-46-13-9-44(10-14-46)40-56-32-4-20-50-26-24-48-16-2-18-54-30-36-56;/h7-14,47-54H,1-6,15-42H2;1H

IUPAC

1,4-bis(4-((1,4,8,11-tetraazacyclotetradecan-1-yl)methyl)benzyl)-1,4,8,11-tetraazacyclotetradecane hydrochloride

Alternate CAS Number

Free Base: 2731552-39-7

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Plerixafor N-1-(4-Methylbenzyl)-1,4,8,11-tetraazacyclotetradecane Hydrochloride

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