CAS RN: 85523-00-8
N-ISOPROPYL-N-METHYL-TERT-BUTYLAMINE
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250610 | 1g / 5g / 25g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS85523-00-8
- Purity/Analytical Methods: >99.0%
85523-00-8 / N,2-dimethyl-N-propan-2-ylpropan-2-amine
Basic Information
CAS
85523-00-8
Multi CAS
Yes
Molecular Formula
C8H19N
Molecular Weight
129.240000
Exact Mass
129.151750
InChI
InChI=1S/C8H19N/c1-7(2)9(6)8(3,4)5/h7H,1-6H3
InChIKey
WYLLBTPEHIVUKV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
42.65
TPSA
3.24
LogP / Solubility
WLOGP
2.13
MLOGP
1.86
XLogP3
2
Consensus LogP
2
Log S (ESOL)
-1.91
Class (ESOL)
Soluble
Log S (Ali)
-2.15
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.38
Class (SILICOS-IT)
Moderately 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
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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