CAS RN: 32703-79-0
4-tert-Butylphthalic Anhydride
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.20250215 | 250mg / 1g / 5g | Confirm by inquiry | Shanghai, Shandong, Hebei | Inquiry |
- Product code: SSC-138356
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: 5g
- Available purity: ≥97%
- 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 |
|---|---|---|---|---|
| 5g | ≥97% | 0 Out of Stock | Beijing | Inquiry |
32703-79-0 / 5-tert-butyl-2-benzofuran-1,3-dione
Basic Information
CAS
32703-79-0
Multi CAS
Yes
Molecular Formula
C12H12O3
Molecular Weight
204.220000
Exact Mass
204.078644
InChI
InChI=1S/C12H12O3/c1-12(2,3)7-4-5-8-9(6-7)11(14)15-10(8)13/h4-6H,1-3H3
InChIKey
YLJYVKLZVHWUCT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
54.89
TPSA
43.37
LogP / Solubility
WLOGP
2.29
MLOGP
2.02
XLogP3
3
Consensus LogP
2.44
Log S (ESOL)
-2.85
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.89
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.89
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)
-2.34
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
-
Bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic Anhydride
- CAS RN: 6708-37-8
- Product Code: SSC-176729
-
-
-
![CAS 6708-37-8 Bicyclo[2.2.2]oct-5-ene-2,3-dicarboxylic Anhydride molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b3038-jpgcontextbwfzdgvyfhjvb3r8mzk2mjh8aw1hz2uvanblz3xonmevagm2lzg5mjg5mta5njy4mtqvqjmwmzguanbnfgrizdu2ytq1zjfmzgzlymi3ogjkogy1otq5y2vknzjlytvmnzywmzkwmjqwngrjmdmzndbln2zlztmwmtewytg.jpeg)
