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CAS 928-98-3 1,5-Pentanedithiol molecular structure lightbox
CAS RN: 928-98-3

1,5-Pentanedithiol

Product Availability

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5 package records3 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251110 1g / 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260119 100g In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20250621 25g Out of stock Inquiry
Batchno.20260326 5g Out of stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260626 1g / 5g / 25g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-206634
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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 928-98-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥97% 0 Out of Stock Shenzhen Inquiry

928-98-3 / pentane-1,5-dithiol

Standard CAS: 928-98-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
928-98-3
Multi CAS
Yes
Molecular Formula
C5H12S2
Molecular Weight
136.300000
Exact Mass
136.038043
InChI
InChI=1S/C5H12S2/c6-4-2-1-3-5-7/h6-7H,1-5H2
InChIKey
KMTUBAIXCBHPIZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
1
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
2
Molar refractivity
41.56
TPSA
2.0000

LogP / Solubility

WLOGP
2.02
MLOGP
1.77
XLogP3
1.9
Consensus LogP
1.9
Log S (ESOL)
-1.69
Class (ESOL)
Soluble
Log S (Ali)
-2.13
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.7
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)
-2.12

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
1.5

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