CAS RN: 97028-90-5
8-(N,N-DIETHYLAMINO)OCTAN-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.20250831 | 100mg / 500mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS97028-90-5
- Purity/Analytical Methods: >99.0%
97028-90-5 / 8-(diethylamino)octan-1-ol
Basic Information
CAS
97028-90-5
Multi CAS
No
Molecular Formula
C12H27NO
Molecular Weight
201.350000
Exact Mass
201.209264
InChI
InChI=1S/C12H27NO/c1-3-13(4-2)11-9-7-5-6-8-10-12-14/h14H,3-12H2,1-2H3
InChIKey
DABAKVQGWZXKFA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Fraction Csp3
1
Rotatable bonds
10
H-bond acceptors
2
H-bond donors
1
Molar refractivity
62.58
TPSA
23.47
LogP / Solubility
WLOGP
2.66
MLOGP
2.34
XLogP3
2.8
Consensus LogP
2.6
Log S (ESOL)
-2.1
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.13
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.38
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)
-2.06
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
-
EOS (d18:1/30:0/18:2)
- CAS RN: 97040-38-5
- Product Code: starshine_CAS97040-38-5
- Purity/Analytical method: >99.0%
-
-
-
4-{[4-(Prop-2-en-1-yloxy)phenyl]sulfonyl}phenol
- CAS RN: 97042-18-7
- Product Code: SSC-212199
![CAS 97042-18-7 4-{[4-(Prop-2-en-1-yloxy)phenyl]sulfonyl}phenol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/97042-18-7.gif)