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CAS 39198-34-0 AZO-TERT-OCTANE molecular structure lightbox
CAS RN: 39198-34-0

AZO-TERT-OCTANE

  • Product code: SSC-146845
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 5g, 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 39198-34-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 5 In Stock Shenzhen Inquiry
0.25g ≥95% 5 In Stock Shanghai Inquiry
5g ≥95% 5 In Stock Shenzhen Inquiry
1g ≥95% 1 In Stock Hong Kong Inquiry

39198-34-0 / bis(2,4,4-trimethylpentan-2-yl)diazene

Standard CAS: 39198-34-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
39198-34-0
Multi CAS
No
Molecular Formula
C16H34N2
Molecular Weight
254.450000
Exact Mass
254.272199
InChI
InChI=1S/C16H34N2/c1-13(2,3)11-15(7,8)17-18-16(9,10)12-14(4,5)6/h11-12H2,1-10H3
InChIKey
WPKWPKDNOPEODE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Fraction Csp3
1
Rotatable bonds
4
H-bond acceptors
2
Molar refractivity
81.16
TPSA
24.72

LogP / Solubility

WLOGP
5.87
MLOGP
5.17
XLogP3
5.6
Consensus LogP
5.55
Log S (ESOL)
-4.85
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.88
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.66
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.11

Drug-likeness / Medicinal Chemistry

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

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