![CAS 70127-50-3 2-[(Diphenylphosphoryl)methyl]phenol molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/h1763-jpgcontextbwfzdgvyfhjvb3r8mjewnjf8aw1hz2uvanblz3xonzivaddhlzkxmzgwmduwmty2mdyvsde3njmuanbnfdg4njvlymvjn2uxmgzjzjq5ytjkogywnjc0ndvizthmnza1otixmgm1zjnjmzrkzgyxmwfhzdbjndg2njnhywm.jpeg)
CAS RN: 70127-50-3
2-[(Diphenylphosphoryl)methyl]phenol
Product Availability
Choose a grade to view its available package options.
6 package records3 with current stock1 grade group
- Product code: SSC-179939
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 0.25g, 1g, 5g, 10g, 25g, 100g
- Available purity: ≥98%
- Inventory rows with stock: 1
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 0.25g | ≥98% | 1 In Stock | Beijing | Inquiry |
| 1g | ≥98% | 0 Out of Stock | Shenzhen | Inquiry |
| 5g | ≥98% | 0 Out of Stock | Hong Kong | Inquiry |
| 10g | ≥98% | 0 Out of Stock | Hong Kong | Inquiry |
| 25g | ≥98% | 0 Out of Stock | Hong Kong | Inquiry |
| 100g | ≥98% | 0 Out of Stock | Shenzhen | Inquiry |
70127-50-3 / 2-(diphenylphosphorylmethyl)phenol
Basic Information
CAS
70127-50-3
Multi CAS
No
Molecular Formula
C19H17O2P
Molecular Weight
308.300000
Exact Mass
308.096617
InChI
InChI=1S/C19H17O2P/c20-19-14-8-7-9-16(19)15-22(21,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-14,20H,15H2
InChIKey
NQWHOPCJTGVYOX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
18
Fraction Csp3
0.05
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
1
Molar refractivity
91.57
TPSA
37.3
LogP / Solubility
WLOGP
3.91
MLOGP
3.45
XLogP3
3.6
Consensus LogP
3.65
Log S (ESOL)
-4.55
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.91
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.39
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.83
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
