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CAS 21791-94-6 Sodium (+)-10-Camphorsulfonate molecular structure lightbox
CAS RN: 21791-94-6

Sodium (+)-10-Camphorsulfonate

Product Availability

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5 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251215 100g In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20250211 1kg Out of stock Inquiry
Batchno.20251119 25g In stock Shanghai, Tianjin Inquiry
Batchno.20260413 500g In stock Tianjin Inquiry
Batchno.20250302 5g Out of stock Inquiry
  • Product code: SSC-105154
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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: 100g
  • 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 21791-94-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ＞97% 0 Out of Stock Shenzhen Inquiry

21791-94-6 / sodium [(1S,4R)-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonate

Standard CAS: 21791-94-6 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
21791-94-6
Multi CAS
No
Molecular Formula
C10H15NaO4S
Molecular Weight
254.280000
Exact Mass
254.058874
SMILES
CC1([C@@H]2CC[C@]1(C(=O)C2)CS(=O)(=O)[O-])C.[Na+]
InChI
InChI=1S/C10H16O4S.Na/c1-9(2)7-3-4-10(9,8(11)5-7)6-15(12,13)14;/h7H,3-6H2,1-2H3,(H,12,13,14);/q;+1/p-1/t7-,10-;/m1./s1
InChIKey
AWMAOFAHBPCBHJ-YZUKSGEXSA-M

Physical Properties

Physical Description
Liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
0.9
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
53.13
TPSA
74.27

LogP / Solubility

WLOGP
-2.07
MLOGP
-1.81
XLogP3
-2.07
Consensus LogP
-1.98
Log S (ESOL)
0.02
Class (ESOL)
Highly soluble
Log S (Ali)
-0.15
Class (Ali)
Very soluble
Log S (SILICOS-IT)
0.16
Class (SILICOS-IT)
Highly soluble

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)
-5.74

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
4.5

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