CAS RN: 1008402-79-6

Bis(NHS)PEG9

Product Availability

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10 package records10 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260630 1g In stock Inquiry
Batchno.20260603 250mg In stock Inquiry
Batchno.20250324 25mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250414 100mg In stock Shandong, Hebei Inquiry
Batchno.20260524 25mg In stock Shandong Inquiry
Batchno.20250319 5mg In stock Shanghai, Shandong, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250317 100mg In stock Shanghai Inquiry
Batchno.20260121 1g In stock Shanghai, Chengdu Inquiry
Batchno.20251028 250mg In stock Shanghai, Shenzhen Inquiry
Batchno.20260423 5g In stock Shanghai, Chengdu Inquiry
  • Product code: SSC-001572
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 0.1g, 0.25g, 1g
  • Available purity: >97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1008402-79-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >97% 0 Out of Stock Hong Kong Inquiry
0.25g >97% 0 Out of Stock Shenzhen Inquiry
1g >97% 0 Out of Stock Hong Kong Inquiry

1008402-79-6 / (2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[2-[2-[2-[2-[2-[2-[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate

Bis-PEG9-NHS ester | NHS-PEG9-NHS | bis(2,5-dioxopyrrolidin-1-yl) 4,7,10,13,16,19,22,25,28-nonaoxahentriacontane-1,31-dioate

Standard CAS: 1008402-79-6 Multi CAS: Yes

Basic Information

CAS
1008402-79-6
Multi CAS
Yes
Molecular Formula
C30H48N2O17
Molecular Weight
708.700000
Exact Mass
708.295298
SMILES
C1CC(=O)N(C1=O)OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)ON2C(=O)CCC2=O
InChI
InChI=1S/C30H48N2O17/c33-25-1-2-26(34)31(25)48-29(37)5-7-39-9-11-41-13-15-43-17-19-45-21-23-47-24-22-46-20-18-44-16-14-42-12-10-40-8-6-30(38)49-32-27(35)3-4-28(32)36/h1-24H2
InChIKey
CQWLSZJYTZVHMU-UHFFFAOYSA-N
Synonyms
Bis-PEG9-NHS ester NHS-PEG9-NHS bis(2,5-dioxopyrrolidin-1-yl) 4,7,10,13,16,19,22,25,28-nonaoxahentriacontane-1,31-dioate Bis(NHS)PEG9 MFCD11041131

Computed Properties

Structural Parameters

Heavy atom count
49
Fraction Csp3
0.8
Rotatable bonds
32
H-bond acceptors
17
Molar refractivity
160.96
TPSA
210.43

LogP / Solubility

WLOGP
-0.87
MLOGP
-0.7
XLogP3
-3.2
Consensus LogP
-1.59
Log S (ESOL)
-1.57
Class (ESOL)
Soluble
Log S (Ali)
-4.74
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-7.38
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-7.66

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4

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