CAS RN: 51805-95-9
2-Amino-2-methylpropanol-d6
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.20260423 | 5mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS51805-95-9
- Purity/Analytical Methods: >99.0%
51805-95-9 / 2-amino-3,3,3-trideuterio-2-(trideuteriomethyl)propan-1-ol
Basic Information
CAS
51805-95-9
Multi CAS
Yes
Molecular Formula
C4H11NO
Molecular Weight
95.170000
Exact Mass
95.121724
InChI
InChI=1S/C4H11NO/c1-4(2,5)3-6/h6H,3,5H2,1-2H3/i1D3,2D3
InChIKey
CBTVGIZVANVGBH-WFGJKAKNSA-N
Computed Properties
Structural Parameters
Heavy atom count
6
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
25.35
TPSA
46.25
LogP / Solubility
WLOGP
-0.28
MLOGP
-0.26
XLogP3
-0.8
Consensus LogP
-0.45
Log S (ESOL)
-0.15
Class (ESOL)
Very soluble
Log S (Ali)
-0.09
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.12
Class (SILICOS-IT)
Very 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)
-3.47
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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