![CAS 59662-47-4 4′-Pentyl-[1,1′-biphenyl]-4-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/59662-47-4.png)
CAS RN: 59662-47-4
4′-Pentyl-[1,1′-biphenyl]-4-carboxylic acid
Product Availability
Choose a grade to view its available package options.
6 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250325 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260112 | 10g | In stock | Shanghai | Inquiry | |
| Batchno.20250312 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20250221 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20250731 | 250mg | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20260102 | 5g | In stock | Shanghai | Inquiry |
- Product code: SSC-168186
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 | Shanghai | Inquiry |
59662-47-4 / 4-(4-pentylphenyl)benzoic acid
Basic Information
CAS
59662-47-4
Multi CAS
No
Molecular Formula
C18H20O2
Molecular Weight
268.300000
Exact Mass
268.146330
InChI
InChI=1S/C18H20O2/c1-2-3-4-5-14-6-8-15(9-7-14)16-10-12-17(13-11-16)18(19)20/h6-13H,2-5H2,1H3,(H,19,20)
InChIKey
VRGQQLFRUKMDSW-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.28
Rotatable bonds
6
H-bond acceptors
1
H-bond donors
1
Molar refractivity
82.07
TPSA
37.3
LogP / Solubility
WLOGP
4.78
MLOGP
4.22
XLogP3
6.1
Consensus LogP
5.03
Log S (ESOL)
-4.57
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.21
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.1
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.96
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
1.5
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![CAS 596-27-0 o-Cresolphthalein (0.04% in ca. 95% Ethanol) [for pH Determination] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/c0218-jpgcontextbwfzdgvyfhjvb3r8mzy5mzn8aw1hz2uvanblz3xon2mvadu4lzg5mjkynzy3mjmymzavqzaymtguanbnfgvmyzi1zdq2odmxnji3mmzjyzhlnzexyzk2ywzimwmznwmxntm1nja3zjlimdy5ngvmztk4mzu0zjewndq4nwu.jpeg)
