CAS RN: 817554-87-3
1-Pyrrolidinecarboxylicacid,3-hydroxy-2-methyl-,1,1-dimethylethylester,(2R,3S)-(9CI)
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.20250824 | 100mg / 250mg / 500mg | Out of stock | 1 business days | Inquiry |
- Product code: SSC-190097
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: 0.1g, 0.25g, 1g
- Available purity: >97%
- Inventory rows with stock: 2
- 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.
817554-87-3 / tert-butyl 3-hydroxy-2-methylpyrrolidine-1-carboxylate
Basic Information
CAS
817554-87-3
Multi CAS
Yes
Molecular Formula
C10H19NO3
Molecular Weight
201.260000
Exact Mass
201.136493
InChI
InChI=1S/C10H19NO3/c1-7-8(12)5-6-11(7)9(13)14-10(2,3)4/h7-8,12H,5-6H2,1-4H3/t7-,8+/m1/s1
InChIKey
RLHMCXQTIPFLRQ-SFYZADRCSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Fraction Csp3
0.9
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
53.03
TPSA
49.77
LogP / Solubility
WLOGP
1.38
MLOGP
1.21
XLogP3
1.1
Consensus LogP
1.23
Log S (ESOL)
-1.96
Class (ESOL)
Soluble
Log S (Ali)
-2.2
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.11
Class (SILICOS-IT)
Moderately 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)
-2.97
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
-
2-hydroxy-2-(4-hydroxy-1-benzothiophen-7-yl)acetate:tributylazanium
- CAS RN: 817586-35-9
- Product Code: starshine_CAS817586-35-9
- Purity/Analytical method: >99.0%
-
tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzylmethylcarbamate
- CAS RN: 817618-31-8
- Product Code: SSC-190102
-
6-Iodopyridine-3-carboxaldehyde
- CAS RN: 817618-55-6
- Product Code: starshine_CAS817618-55-6
- Purity/Analytical method: >99.0%
-
N-[({4-[(benzylamino)sulfonyl]phenyl}amino)carbonothioyl]benzamide
- CAS RN: 817635-93-1
- Product Code: starshine_CAS817635-93-1
- Purity/Analytical method: >99.0%
-
1-Tert-Butyl-3-Cyclobutyl-1H-pyrazol-5-amine
- CAS RN: 817641-86-4
- Product Code: SSC-190106
![CAS 817635-93-1 N-[({4-[(benzylamino)sulfonyl]phenyl}amino)carbonothioyl]benzamide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/817635-93-1.gif)
