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CAS 1171122-72-7 N3-PEG10-N3 molecular structure lightbox
CAS RN: 1171122-72-7

N3-PEG10-N3

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260303 250mg / 1g Out of stock 15 business days Inquiry
  • Product code: SSC-016955
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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: 1g
  • Available purity: ≥95%
  • 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 1171122-72-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1171122-72-7 / 1-azido-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethane

Azido-PEG9-azide | 1,29-Diazido-3,6,9,12,15,18,21,24,27-nonaoxanonacosane | Azide-PEG9-azide

Standard CAS: 1171122-72-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1171122-72-7
Multi CAS
No
Molecular Formula
C20H40N6O9
Molecular Weight
508.600000
Exact Mass
508.285677
SMILES
C(COCCOCCOCCOCCOCCOCCOCCOCCOCCN=[N+]=[N-])N=[N+]=[N-]
InChI
InChI=1S/C20H40N6O9/c21-25-23-1-3-27-5-7-29-9-11-31-13-15-33-17-19-35-20-18-34-16-14-32-12-10-30-8-6-28-4-2-24-26-22/h1-20H2
InChIKey
SWOJCRLGINETDK-UHFFFAOYSA-N
Synonyms
Azido-PEG9-azide 1,29-Diazido-3,6,9,12,15,18,21,24,27-nonaoxanonacosane Azide-PEG9-azide orb1307534 YSZC3698

Computed Properties

Structural Parameters

Heavy atom count
35
Fraction Csp3
1
Rotatable bonds
30
H-bond acceptors
11
Molar refractivity
125.4
TPSA
180.59

LogP / Solubility

WLOGP
1.76
MLOGP
1.58
XLogP3
0.7
Consensus LogP
1.35
Log S (ESOL)
-2.12
Class (ESOL)
Moderately soluble
Log S (Ali)
-5
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-8.02
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.58

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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