CAS RN: 300762-25-8
1-Hexanol, 6,6′-oxybis[2,2-dimethyl-
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251124 | 5mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS300762-25-8
- Purity/Analytical Methods: >99.0%
300762-25-8 / 6-(6-hydroxy-5,5-dimethylhexoxy)-2,2-dimethylhexan-1-ol
Basic Information
CAS
300762-25-8
Multi CAS
No
Molecular Formula
C16H34O3
Molecular Weight
274.440000
Exact Mass
274.250795
InChI
InChI=1S/C16H34O3/c1-15(2,13-17)9-5-7-11-19-12-8-6-10-16(3,4)14-18/h17-18H,5-14H2,1-4H3
InChIKey
ULDZFCNXQRYRSI-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Fraction Csp3
1
Rotatable bonds
12
H-bond acceptors
3
H-bond donors
2
Molar refractivity
80.25
TPSA
49.69
LogP / Solubility
WLOGP
3.38
MLOGP
2.98
XLogP3
3.2
Consensus LogP
3.19
Log S (ESOL)
-2.88
Class (ESOL)
Moderately soluble
Log S (Ali)
-4.25
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.69
Class (SILICOS-IT)
Slightly 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)
-1.99
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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