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CAS 26978-64-3 4-Hydroxybutane-1-sulfonic acid molecular structure lightbox
CAS RN: 26978-64-3

4-Hydroxybutane-1-sulfonic acid

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251027 50mg / 250mg / 1g / 5g / 25g Confirm by inquiry Shanghai, Shandong 5-7 business days Inquiry
  • Product code: SSC-125488
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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 26978-64-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

26978-64-3 / bromo(methoxy)methane

Standard CAS: 26978-64-3 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
26978-64-3
Multi CAS
No
Molecular Formula
C2H5BrO
Molecular Weight
124.960000
Exact Mass
123.952380
SMILES
COCBr
InChI
InChI=1S/C2H5BrO/c1-4-2-3/h2H2,1H3
InChIKey
JAMFGQBENKSWOF-UHFFFAOYSA-N

Physical Properties

Physical Description
Colorless liquid with a pungent odor
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
4
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
20.8
TPSA
9.23

LogP / Solubility

WLOGP
0.99
MLOGP
0.86
XLogP3
0.9
Consensus LogP
0.92
Log S (ESOL)
-1.17
Class (ESOL)
Soluble
Log S (Ali)
-1.3
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.41
Class (SILICOS-IT)
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)
-2.78

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
1

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