CAS RN: 71616-84-7
4-(4-METHOXY-BENZOYL)-BENZOIC ACIDMETHYL ESTER
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.20251101 | 100mg / 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-181186
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: 1g
- 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 |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Beijing | Inquiry |
71616-84-7 / methyl 4-(4-methoxybenzoyl)benzoate
Basic Information
CAS
71616-84-7
Multi CAS
Yes
Molecular Formula
C16H14O4
Molecular Weight
270.280000
Exact Mass
270.089209
InChI
InChI=1S/C16H14O4/c1-19-14-9-7-12(8-10-14)15(17)11-3-5-13(6-4-11)16(18)20-2/h3-10H,1-2H3
InChIKey
XISRQQMWSGOFJV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.12
Rotatable bonds
4
H-bond acceptors
4
Molar refractivity
74.21
TPSA
52.6
LogP / Solubility
WLOGP
2.71
MLOGP
2.4
XLogP3
3.6
Consensus LogP
2.9
Log S (ESOL)
-3.4
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.73
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.15
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.44
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
Benalaxyl
- CAS RN: 71626-11-4
- Product Code: starshine_CAS71626-11-4
- Purity/Analytical method: >99.0%
-
CALCIUM IODIDE HYDRATE
- CAS RN: 71626-98-7
- Product Code: starshine_CAS71626-98-7
- Purity/Analytical method: >99.0%
-
10-Deacetyl
- CAS RN: 71629-92-0
- Product Code: starshine_CAS71629-92-0
- Purity/Analytical method: >99.0%
-
-
N-[2-Hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-chloro-3,4-dimethoxyphenyl)ethylamine
- CAS RN: 71636-38-9
- Product Code: starshine_CAS71636-38-9
- Purity/Analytical method: >99.0%
![CAS 71636-38-9 N-[2-Hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-chloro-3,4-dimethoxyphenyl)ethylamine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/71636-38-9.gif)