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CAS 2168-93-6 Dibutyl Sulfoxide molecular structure lightbox
CAS RN: 2168-93-6

Dibutyl Sulfoxide

Product Availability

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2 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250129 1g In stock Shanghai, Guangdong, Chongqing Inquiry
Batchno.20260614 5g In stock Shanghai, Shandong, Guangdong Inquiry
  • Product code: SSC-104162
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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: ≥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 2168-93-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥95% 0 Out of Stock Shenzhen Inquiry

2168-93-6 / 1-butylsulfinylbutane

Standard CAS: 2168-93-6 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
2168-93-6
Multi CAS
No
Molecular Formula
C8H18OS
Molecular Weight
162.300000
Exact Mass
162.107836
SMILES
CCCCS(=O)CCCC
InChI
InChI=1S/C8H18OS/c1-3-5-7-10(9)8-6-4-2/h3-8H2,1-2H3
InChIKey
LOWMYOWHQMKBTM-UHFFFAOYSA-N

Physical Properties

Physical Description
White to pale yellow hygroscopic solid; mp = 31-34 deg C
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
6
H-bond acceptors
1
Molar refractivity
47.69
TPSA
17.07

LogP / Solubility

WLOGP
2.34
MLOGP
2.05
XLogP3
1.8
Consensus LogP
2.06
Log S (ESOL)
-1.92
Class (ESOL)
Soluble
Log S (Ali)
-2.58
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.37
Class (SILICOS-IT)
Poorly 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)
-2.05

Drug-likeness / Medicinal Chemistry

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

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