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CAS 6994-45-2 Sodium 1-Tetradecanesulfonate molecular structure lightbox
CAS RN: 6994-45-2

Sodium 1-Tetradecanesulfonate

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250703 10g In stock Shanghai Inquiry
Batchno.20250219 1g In stock Shanghai Inquiry
Batchno.20250917 5g In stock Shanghai Inquiry
  • Product code: SSC-179711
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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: 5g
  • 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 6994-45-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Hong Kong Inquiry

6994-45-2 / sodium tetradecane-1-sulfonate

Standard CAS: 6994-45-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
6994-45-2
Multi CAS
Yes
Molecular Formula
C14H29NAO3S
Molecular Weight
300.440000
Exact Mass
300.173510
InChI
InChI=1S/C14H30O3S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18(15,16)17;/h2-14H2,1H3,(H,15,16,17);/q;+1/p-1
InChIKey
AYFACLKQYVTXNS-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
19
Fraction Csp3
1
Rotatable bonds
13
H-bond acceptors
3
Molar refractivity
75.64
TPSA
57.2

LogP / Solubility

WLOGP
1.24
MLOGP
1.1
XLogP3
1.24
Consensus LogP
1.19
Log S (ESOL)
-1.62
Class (ESOL)
Soluble
Log S (Ali)
-2.92
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-4.2
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.67

Drug-likeness / Medicinal Chemistry

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

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