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CAS 118162-45-1 11-Azido-undecanoic acid molecular structure lightbox
CAS RN: 118162-45-1

11-Azido-undecanoic acid

Product Availability

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5 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260210 100mg In stock Shanghai Inquiry
Batchno.20251010 1g In stock Shanghai Inquiry
Batchno.20250915 250mg In stock Shanghai Inquiry
Batchno.20251212 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250720 100mg / 250mg / 500mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-017990
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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 118162-45-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

118162-45-1 / 11-azidoundecanoic acid

11-azidoundecanoic acid | 11-Azido-undecanoic acid | MFCD27941954

Standard CAS: 118162-45-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
118162-45-1
Multi CAS
No
Molecular Formula
C11H21N3O2
Molecular Weight
227.300000
Exact Mass
227.163377
SMILES
C(CCCCCN=[N+]=[N-])CCCCC(=O)O
InChI
InChI=1S/C11H21N3O2/c12-14-13-10-8-6-4-2-1-3-5-7-9-11(15)16/h1-10H2,(H,15,16)
InChIKey
LXAVFOAOGZWQKT-UHFFFAOYSA-N
Synonyms
11-azidoundecanoic acid 11-Azido-undecanoic acid MFCD27941954 11Az undec acid 11-Azido undecanoic acid

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
0.91
Rotatable bonds
11
H-bond acceptors
2
H-bond donors
1
Molar refractivity
63.2
TPSA
86.06

LogP / Solubility

WLOGP
3.89
MLOGP
3.43
XLogP3
4.4
Consensus LogP
3.91
Log S (ESOL)
-2.98
Class (ESOL)
Moderately soluble
Log S (Ali)
-4.23
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.69
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
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)
-1.34

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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