[email protected]
CAS 105-65-7 Isopropylxanthic disulfide molecular structure lightbox
CAS RN: 105-65-7

Isopropylxanthic disulfide

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250918 100g In stock Inquiry
Batchno.20260605 25g In stock Inquiry
Batchno.20250217 500g In stock Inquiry
Batchno.20250308 5g In stock Inquiry
  • Product code: starshine_CAS105-65-7
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

105-65-7 / O-propan-2-yl (propan-2-yloxycarbothioyldisulfanyl)methanethioate

Diproxide | Diisopropyl xanthogen disulfide | Diproxid

Standard CAS: 105-65-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
105-65-7
Multi CAS
Yes
Molecular Formula
C8H14O2S4
Molecular Weight
270.500000
Exact Mass
269.987664
SMILES
CC(C)OC(=S)SSC(=S)OC(C)C
InChI
InChI=1S/C8H14O2S4/c1-5(2)9-7(11)13-14-8(12)10-6(3)4/h5-6H,1-4H3
InChIKey
ZWWQICJTBOCQLA-UHFFFAOYSA-N
Synonyms
Diproxide Diisopropyl xanthogen disulfide Diproxid Diisopropylxanthogen disulfide Diisopropyl dixanthogen

Computed Properties

Structural Parameters

Heavy atom count
14
Fraction Csp3
0.75
Rotatable bonds
2
H-bond acceptors
6
Molar refractivity
72.82
TPSA
18.46

LogP / Solubility

WLOGP
3.79
MLOGP
3.34
XLogP3
4.1
Consensus LogP
3.74
Log S (ESOL)
-3.77
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.51
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.8
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
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)
-1.68

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us