CAS RN: 68399-80-4

3-[N,N-Bis(2-hydroxyethyl)amino]-2-hydroxypropanesulfonic Acid

Product Availability

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15 package records14 with current stock4 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250311 100g In stock Inquiry
Batchno.20260427 100g In stock Shanghai, Shandong, Guangdong, Hebei Inquiry
Batchno.20260206 2.5kg In stock Shandong Inquiry
Batchno.20250523 25g In stock Inquiry
Batchno.20250702 25g In stock Shanghai, Shandong Inquiry
Batchno.20260214 500g In stock Inquiry
Batchno.20250319 500g In stock Shanghai, Shandong, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250616 100g In stock Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20251214 10g In stock Shanghai Inquiry
Batchno.20250829 1kg Out of stock Inquiry
Batchno.20251119 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250705 500g In stock Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251104 5g In stock Shenzhen, Tianjin Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251226 5g / 25g / 100g Confirm by inquiry Shanghai 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260211 10g / 50g / 250g Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-178140
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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 68399-80-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥97% 0 Out of Stock Hong Kong Inquiry

68399-80-4 / 3-[bis(2-hydroxyethyl)amino]-2-hydroxypropane-1-sulfonic acid

Standard CAS: 68399-80-4 Multi CAS: Yes

Basic Information

CAS
68399-80-4
Multi CAS
Yes
Molecular Formula
C7H17NO6S
Molecular Weight
243.280000
Exact Mass
243.077658
InChI
InChI=1S/C7H17NO6S/c9-3-1-8(2-4-10)5-7(11)6-15(12,13)14/h7,9-11H,1-6H2,(H,12,13,14)
InChIKey
XCBLFURAFHFFJF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
1
Rotatable bonds
8
H-bond acceptors
6
H-bond donors
4
Molar refractivity
53.03
TPSA
118.3

LogP / Solubility

WLOGP
-2.48
MLOGP
-2.18
XLogP3
-5.1
Consensus LogP
-3.25
Log S (ESOL)
0.74
Class (ESOL)
Highly soluble
Log S (Ali)
0.23
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
-0.14
Class (SILICOS-IT)
Very 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)
-5.96

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2

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