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, 1g, 5g, 25g, 0.25g, 10g, 100g
- Available purity: >98%
- Inventory rows with stock: 7
- 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 |
|---|---|---|---|---|
| 0.1g | >98% | 5 In Stock | Shanghai | Inquiry |
| 1g | >98% | 5 In Stock | Hong Kong | Inquiry |
| 5g | >98% | 5 In Stock | Beijing | Inquiry |
| 25g | >98% | 5 In Stock | Shanghai | Inquiry |
| 0.25g | >98% | 4 In Stock | Shanghai | Inquiry |
| 10g | >98% | 4 In Stock | Hong Kong | Inquiry |
| 100g | >98% | 3 In Stock | Shenzhen | Inquiry |
287174-32-7 / tert-butyl 2-(2-hydroxyethoxy)acetate
Basic Information
CAS
287174-32-7
Multi CAS
No
Molecular Formula
C8H16O4
Molecular Weight
176.210000
Exact Mass
176.104859
SMILES
CC(C)(C)OC(=O)COCCO
InChI
InChI=1S/C8H16O4/c1-8(2,3)12-7(10)6-11-5-4-9/h9H,4-6H2,1-3H3
InChIKey
GIDDJWYPWOFCCS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Fraction Csp3
0.88
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
1
Molar refractivity
43.75
TPSA
55.76
LogP / Solubility
WLOGP
0.34
MLOGP
0.29
XLogP3
0.3
Consensus LogP
0.31
Log S (ESOL)
-0.88
Class (ESOL)
Very soluble
Log S (Ali)
-1.25
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.57
Class (SILICOS-IT)
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)
-3.56
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
1.5
Customers Also Viewed
-
-
6-BROMO-2-CHLOROQUINOLINE-4-CARBOXYLIC ACID, 97
- CAS RN: 287176-62-9
- Product Code: SSC-130352
-
-
sodiuM 2,3,3-triMethyl-3H-indole-5-sulfonate
- CAS RN: 287188-58-3
- Product Code: SSC-130362
-
3-Ethynyl-3-hydroxy-piperidine-1-carboxylic acid tert-butyl ester
- CAS RN: 287192-85-2
- Product Code: SSC-130363
-
![CAS 287177-82-6 1H-Pyrazolo[3,4-d]pyrimidin-6-amine (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/287177-82-6.png)
