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CAS 4306-65-4 1,1,3,5-Tetramethylcyclohexane molecular structure lightbox
CAS RN: 4306-65-4

1,1,3,5-Tetramethylcyclohexane

  • Product code: SSC-151363
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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: 5ml
  • 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 4306-65-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5ml ＞95% 0 Out of Stock Beijing Inquiry

4306-65-4 / 1,1,3,5-tetramethylcyclohexane

Standard CAS: 4306-65-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
4306-65-4
Multi CAS
No
Molecular Formula
C10H20
Molecular Weight
140.270000
Exact Mass
140.156501
InChI
InChI=1S/C10H20/c1-8-5-9(2)7-10(3,4)6-8/h8-9H,5-7H2,1-4H3
InChIKey
WOJSMJIXPQLESQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
1
Molar refractivity
45.96
TPSA
0.0000

LogP / Solubility

WLOGP
3.47
MLOGP
3.05
XLogP3
4.4
Consensus LogP
3.64
Log S (ESOL)
-2.89
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.21
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.45
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)
-1.11

Drug-likeness / Medicinal Chemistry

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

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