CAS RN: 36821-26-8
2-OXO-PYRROLIDINE-3-CARBOXYLIC ACID ETHYL ESTER
- Product code: SSC-144068
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 1g, 0.25g, 0.1g, 10g, 5g, 25g
- Available purity: >95%
- Inventory rows with stock: 5
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | >95% | 5 In Stock | Shanghai | Inquiry |
| 0.25g | >95% | 4 In Stock | Hong Kong | Inquiry |
| 0.1g | >95% | 2 In Stock | Shenzhen | Inquiry |
| 10g | >95% | 2 In Stock | Hong Kong | Inquiry |
| 5g | >95% | 1 In Stock | Shenzhen | Inquiry |
| 25g | >95% | 0 Out of Stock | Shanghai | Inquiry |
36821-26-8 / ethyl 2-oxopyrrolidine-3-carboxylate
Basic Information
CAS
36821-26-8
Multi CAS
Yes
Molecular Formula
C7H11NO3
Molecular Weight
157.170000
Exact Mass
157.073893
InChI
InChI=1S/C7H11NO3/c1-2-11-7(10)5-3-4-8-6(5)9/h5H,2-4H2,1H3,(H,8,9)
InChIKey
FHHMWJMUMOYGQW-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
0.71
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
37.75
TPSA
55.4
LogP / Solubility
WLOGP
-0.31
MLOGP
-0.28
XLogP3
0.1
Consensus LogP
-0.16
Log S (ESOL)
-0.48
Class (ESOL)
Very soluble
Log S (Ali)
-0.62
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.66
Class (SILICOS-IT)
Very 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)
-3.9
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2
![CAS 36822-08-9 3H-BENZO[4,5]THIENO[3,2-D]PYRIMIDIN-4-ONE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB8375281(1).gif)
![CAS 36822-09-0 4-chlorobenzo[4,5]thieno[3,2-d]pyrimidine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/36822-09-0.gif)
