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CAS 84-71-9 bis(2-ethylhexyl) cyclohexane-1,2-dicarboxylate molecular structure lightbox
CAS RN: 84-71-9

bis(2-ethylhexyl) cyclohexane-1,2-dicarboxylate

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260301 100g In stock Shanghai, Shenzhen, Chengdu Inquiry
Batchno.20250722 25g In stock Shanghai, Shenzhen, Chengdu Inquiry
Batchno.20260405 500g In stock Shanghai Inquiry
Batchno.20251110 5g In stock Shanghai Inquiry
  • Product code: SSC-191626
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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: 10g
  • 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 84-71-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥97% 0 Out of Stock Shanghai Inquiry

84-71-9 / bis(2-ethylhexyl) cyclohexane-1,2-dicarboxylate

Standard CAS: 84-71-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
84-71-9
Multi CAS
Yes
Molecular Formula
C24H44O4
Molecular Weight
396.600000
Exact Mass
396.323960
InChI
InChI=1S/C24H44O4/c1-5-9-13-19(7-3)17-27-23(25)21-15-11-12-16-22(21)24(26)28-18-20(8-4)14-10-6-2/h19-22H,5-18H2,1-4H3
InChIKey
DIMOQAGSNHTROK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
28
Fraction Csp3
0.92
Rotatable bonds
14
H-bond acceptors
4
Molar refractivity
113.98
TPSA
52.6

LogP / Solubility

WLOGP
6.31
MLOGP
5.58
XLogP3
7.8
Consensus LogP
6.56
Log S (ESOL)
-5.35
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.37
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.16
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)
-0.66

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5

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