CAS RN: 14641-24-8
3-(2-hydroxyethoxy)propane-1,2-diol
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.20250605 | 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS14641-24-8
- Purity/Analytical Methods: >99.0%
14641-24-8 / 3-(2-hydroxyethoxy)propane-1,2-diol
Basic Information
CAS
14641-24-8
Multi CAS
No
Molecular Formula
C5H12O4
Molecular Weight
136.150000
Exact Mass
136.073559
SMILES
C(COCC(CO)O)O
InChI
InChI=1S/C5H12O4/c6-1-2-9-4-5(8)3-7/h5-8H,1-4H2
InChIKey
YHXNHYKKDRMEEH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
5
H-bond acceptors
4
H-bond donors
3
Molar refractivity
31
TPSA
69.92
LogP / Solubility
WLOGP
-1.65
MLOGP
-1.46
XLogP3
-1.9
Consensus LogP
-1.67
Log S (ESOL)
0.69
Class (ESOL)
Highly soluble
Log S (Ali)
0.52
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.23
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
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)
-4.72
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
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