CAS RN: 67885-97-6
(1R,2R)-4-oxocyclopentane-1,2-dicarboxylic acid
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.20250321 | 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-177635
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: ≥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 |
|---|---|---|---|---|
| 1g | ≥98% | 0 Out of Stock | Shenzhen | Inquiry |
67885-97-6 / 4-oxocyclopentane-1,2-dicarboxylic acid
Basic Information
CAS
67885-97-6
Multi CAS
Yes
Molecular Formula
C7H8O5
Molecular Weight
172.130000
Exact Mass
172.037173
InChI
InChI=1S/C7H8O5/c8-3-1-4(6(9)10)5(2-3)7(11)12/h4-5H,1-2H2,(H,9,10)(H,11,12)/t4-,5-/m1/s1
InChIKey
CJSMOECOKYPHSC-RFZPGFLSSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Fraction Csp3
0.57
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
36.49
TPSA
91.67
LogP / Solubility
WLOGP
-0.25
MLOGP
-0.22
XLogP3
-1.3
Consensus LogP
-0.59
Log S (ESOL)
-0.62
Class (ESOL)
Very soluble
Log S (Ali)
-0.79
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.81
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.95
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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