CAS RN: 42521-46-0
(9Z,12E)-9,12-Tetradecadien-1-ol
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.20260220 | 25mg / 100mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS42521-46-0
- Purity/Analytical Methods: >99.0%
42521-46-0 / tetradeca-9,12-dien-1-ol
Basic Information
CAS
42521-46-0
Multi CAS
Yes
Molecular Formula
C14H26O
Molecular Weight
210.360000
Exact Mass
210.198365
InChI
InChI=1S/C14H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-3,5-6,15H,4,7-14H2,1H3/b3-2+,6-5-
InChIKey
IHRPKOQVBCPMQH-OHAITUNLSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Fraction Csp3
0.71
Rotatable bonds
10
H-bond acceptors
1
H-bond donors
1
Molar refractivity
67.98
TPSA
20.23
LogP / Solubility
WLOGP
4.23
MLOGP
3.73
XLogP3
4.7
Consensus LogP
4.22
Log S (ESOL)
-3.15
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.34
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.74
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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