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CAS 42235-38-1 Dimethyl Icosanedioate molecular structure lightbox
CAS RN: 42235-38-1

Dimethyl Icosanedioate

Product Availability

Choose a grade to view its available package options.

6 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250510 25g In stock Inquiry
Batchno.20250115 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260208 100g In stock Shanghai Inquiry
Batchno.20260513 1g In stock Shanghai Inquiry
Batchno.20260428 25g In stock Shanghai Inquiry
Batchno.20250811 5g In stock Shanghai Inquiry
  • Product code: SSC-150569
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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: 5g
  • 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 42235-38-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shenzhen Inquiry

42235-38-1 / dimethyl icosanedioate

Standard CAS: 42235-38-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
42235-38-1
Multi CAS
Yes
Molecular Formula
C22H42O4
Molecular Weight
370.600000
Exact Mass
370.308310
InChI
InChI=1S/C22H42O4/c1-25-21(23)19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22(24)26-2/h3-20H2,1-2H3
InChIKey
PODMJVMUYCFFMK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
26
Fraction Csp3
0.91
Rotatable bonds
19
H-bond acceptors
4
Molar refractivity
107.14
TPSA
52.6

LogP / Solubility

WLOGP
6.35
MLOGP
5.61
XLogP3
8.4
Consensus LogP
6.79
Log S (ESOL)
-4.89
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.19
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.62
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.47

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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