![CAS 5301-78-0 4-Hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane 1-Oxide molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/h1548-jpgcontextbwfzdgvyfhjvb3r8mzuynjn8aw1hz2uvanblz3xonjcvadk5lzg5mzewmzm0odeyndyvsde1ndguanbnfgziy2fjzwrhyzfhnzkzzjhhmzziyjy1mtzkotfhnjnkztg0mwizmtg5y2y5otk4mwvhmjmyn2q5yjfjmzk1mwm.jpeg)
CAS RN: 5301-78-0
4-Hydroxymethyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane 1-Oxide
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.20250716 | 1g / 5g / 25g / 100g / 500g | Confirm by inquiry | Shanghai, Shandong | Inquiry |
- Product code: SSC-160193
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: 100g
- Available purity: ≥98%
- 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 |
|---|---|---|---|---|
| 100g | ≥98% | 0 Out of Stock | Shenzhen | Inquiry |
5301-78-0 / (1-oxo-2,6,7-trioxa-1lambda5-phosphabicyclo[2.2.2]octan-4-yl)methanol
Basic Information
CAS
5301-78-0
Multi CAS
No
Molecular Formula
C5H9O5P
Molecular Weight
180.100000
Exact Mass
180.018760
InChI
InChI=1S/C5H9O5P/c6-1-5-2-8-11(7,9-3-5)10-4-5/h6H,1-4H2
InChIKey
YASRHLDAFCMIPB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
1
Molar refractivity
34.98
TPSA
64.99
LogP / Solubility
WLOGP
0.15
MLOGP
0.13
XLogP3
-1.5
Consensus LogP
-0.41
Log S (ESOL)
-0.99
Class (ESOL)
Very soluble
Log S (Ali)
-1.15
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.08
Class (SILICOS-IT)
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)
-3.71
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5
