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CAS 13419-61-9 Sodium 1-Decanesulfonate [Reagent for Ion-Pair Chromatography] molecular structure lightbox
CAS RN: 13419-61-9

Sodium 1-Decanesulfonate [Reagent for Ion-Pair Chromatography]

Product Availability

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10 package records8 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260506 100g In stock Shanghai, Shenzhen Inquiry
Batchno.20260425 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250126 500g Out of stock Inquiry
Batchno.20260616 5g In stock Shanghai, Tianjin Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250502 1g / 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250116 100g In stock Inquiry
Batchno.20250803 1g In stock Inquiry
Batchno.20260602 25g In stock Inquiry
Batchno.20251029 500g Out of stock Inquiry
Batchno.20251025 5g In stock Inquiry
  • Product code: SSC-041596
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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: 25g
  • 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 13419-61-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ＞97% 0 Out of Stock Shenzhen Inquiry

13419-61-9 / sodium decane-1-sulfonate

Standard CAS: 13419-61-9 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
13419-61-9
Multi CAS
No
Molecular Formula
C10H21NaO3S
Molecular Weight
244.330000
Exact Mass
244.110910
SMILES
CCCCCCCCCCS(=O)(=O)[O-].[Na+]
InChI
InChI=1S/C10H22O3S.Na/c1-2-3-4-5-6-7-8-9-10-14(11,12)13;/h2-10H2,1H3,(H,11,12,13);/q;+1/p-1
InChIKey
AIMUHNZKNFEZSN-UHFFFAOYSA-M

Physical Properties

Physical Description
93% by weight: Colorless or yellowish solid; [SIDS Dossier] White hygroscopic crystals
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
1
Rotatable bonds
9
H-bond acceptors
3
Molar refractivity
57.17
TPSA
57.2

LogP / Solubility

WLOGP
-0.32
MLOGP
-0.28
XLogP3
-0.32
Consensus LogP
-0.31
Log S (ESOL)
-0.56
Class (ESOL)
Very soluble
Log S (Ali)
-1.33
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.06
Class (SILICOS-IT)
Moderately 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)
-4.44

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Corrosive Irritant
Signal
Danger
GHS Hazard Statements
H302 (71.2%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (98.6%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (71.2%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H319 (27.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (27.4%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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