CAS RN: 90-72-2
2,4,6-Tris(dimethylaminomethyl)phenol
Product Availability
Choose a grade to view its available package options.
8 package records8 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260404 | 100g | In stock | Shanghai, Shandong, Guangdong, Hebei | Inquiry |
| Batchno.20250125 | 100g | In stock | Inquiry | |
| Batchno.20260223 | 2.5kg | In stock | Shanghai | Inquiry |
| Batchno.20251228 | 2.5kg | In stock | Inquiry | |
| Batchno.20250118 | 25g | In stock | Inquiry | |
| Batchno.20250822 | 500g | In stock | Shanghai, Guangdong | Inquiry |
| Batchno.20250504 | 500g | In stock | Inquiry | |
| Batchno.20251107 | 5g | In stock | Inquiry |
- Product code: SSC-202295
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 500g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 500g | ≥95% | 0 Out of Stock | Shanghai | Inquiry |
90-72-2 / 2,4,6-tris[(dimethylamino)methyl]phenol
Basic Information
CAS
90-72-2
Multi CAS
Yes
Molecular Formula
C15H27N3O
Molecular Weight
265.390000
Exact Mass
265.215412
InChI
InChI=1S/C15H27N3O/c1-16(2)9-12-7-13(10-17(3)4)15(19)14(8-12)11-18(5)6/h7-8,19H,9-11H2,1-6H3
InChIKey
AHDSRXYHVZECER-UHFFFAOYSA-N
Physical Properties
Boiling Point
BP: 130-135 °C at 1 mm Hg
Physical Description
2,4,6-tridimethylaminomethyl phenol appears as an amber to red-brown liquid with an amine odor. Less dense than water. Vapors heavier than air. Corrosive to the eyes, skin, mouth, stomach and throat. Vapors may irritate the eyes and corrode the upper respiratory tract.
Liquid
Liquid; [IUCLID] Clear, light yellow viscous liquid
Appearance
Clear, light yellow, viscous liquid
State
Liquid
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.6
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
1
Molar refractivity
80.28
TPSA
29.95
LogP / Solubility
WLOGP
1.58
MLOGP
1.4
XLogP3
1.1
Consensus LogP
1.36
Log S (ESOL)
-2.32
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.87
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.41
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.22
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
