CAS RN: 184528-76-5
(R)-2,3-Dihydroxy-3-Methyl-Butyric Acid Benzyl Ester
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.20251122 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-085308
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 |
184528-76-5 / benzyl (2R)-2,3-dihydroxy-3-methylbutanoate
Basic Information
CAS
184528-76-5
Multi CAS
No
Molecular Formula
C12H16O4
Molecular Weight
224.250000
Exact Mass
224.104859
SMILES
CC(C)([C@H](C(=O)OCC1=CC=CC=C1)O)O
InChI
InChI=1S/C12H16O4/c1-12(2,15)10(13)11(14)16-8-9-6-4-3-5-7-9/h3-7,10,13,15H,8H2,1-2H3/t10-/m0/s1
InChIKey
HUYOGRCHSFVCNV-JTQLQIEISA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.42
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
2
Molar refractivity
58.54
TPSA
66.76
LogP / Solubility
WLOGP
0.86
MLOGP
0.76
XLogP3
0.9
Consensus LogP
0.84
Log S (ESOL)
-1.79
Class (ESOL)
Soluble
Log S (Ali)
-2.02
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.31
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)
-3.48
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
-
(S)-2-aMino-3-(4-((2-nitrobenzyl)oxy)phenyl)propanoic acid hydrochloride
- CAS RN: 184591-51-3
- Product Code: SSC-085334
-
-
[1,1′:3′,1”-Terphenyl]-3,3”-diamine, 5′-(3-aminophenyl)-
- CAS RN: 184650-02-0
- Product Code: starshine_CAS184650-02-0
- Purity/Analytical method: >99.0%
-
Carabersat
- CAS RN: 184653-84-7
- Product Code: starshine_CAS184653-84-7
- Purity/Analytical method: >99.0%
-
(S)-(-)-2-(a-(i-propyl)methanamine)-1H-benzimidazole, min. 98% (S)-i-Pr-BIMAH
- CAS RN: 184685-11-8
- Product Code: SSC-085376
![CAS 184650-02-0 [1,1′:3′,1”-Terphenyl]-3,3”-diamine, 5′-(3-aminophenyl)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/184650-02-0.gif)
