CAS RN: 4942-47-6
1-Adamantaneacetic Acid
Product Availability
Choose a grade to view its available package options.
15 package records13 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260303 | 100g | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250122 | 100g | In stock | Shanghai | Inquiry |
| Batchno.20250409 | 10g | In stock | Shanghai, Tianjin, Wuhan | Inquiry |
| Batchno.20260427 | 1g | In stock | Shanghai, Tianjin, Chengdu | Inquiry |
| Batchno.20251019 | 1g | In stock | Shanghai, Shandong, Hebei | Inquiry |
| Batchno.20250710 | 25g | In stock | Shanghai, Shenzhen, Tianjin, Chengdu | Inquiry |
| Batchno.20251030 | 25g | In stock | Shandong, Chongqing | Inquiry |
| Batchno.20250831 | 500g | Out of stock | Inquiry | |
| Batchno.20260330 | 5g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20260529 | 5g | In stock | Shanghai, Shandong | Inquiry |
- Product code: SSC-155682
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, 10g, 25g, 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.
4942-47-6 / 2-(1-adamantyl)acetic acid
Basic Information
CAS
4942-47-6
Multi CAS
Yes
Molecular Formula
C12H18O2
Molecular Weight
194.270000
Exact Mass
194.130680
InChI
InChI=1S/C12H18O2/c13-11(14)7-12-4-8-1-9(5-12)3-10(2-8)6-12/h8-10H,1-7H2,(H,13,14)
InChIKey
AOTQGWFNFTVXNQ-UHFFFAOYSA-N
Physical Properties
Physical Description
White solid
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
14
Fraction Csp3
0.92
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
52.86
TPSA
37.3
LogP / Solubility
WLOGP
2.68
MLOGP
2.36
XLogP3
3.2
Consensus LogP
2.75
Log S (ESOL)
-2.6
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.09
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.39
Class (SILICOS-IT)
Poorly 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
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
6
