CAS RN: 13588-28-8
2-(2-methoxypropoxy)propan-1-ol
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.20251028 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS13588-28-8
- Purity/Analytical Methods: >99.0%
13588-28-8 / 2-(2-methoxypropoxy)propan-1-ol
Basic Information
CAS
13588-28-8
Multi CAS
No
Molecular Formula
C7H16O3
Molecular Weight
148.200000
Exact Mass
148.109944
SMILES
CC(CO)OCC(C)OC
InChI
InChI=1S/C7H16O3/c1-6(4-8)10-5-7(2)9-3/h6-8H,4-5H2,1-3H3
InChIKey
CUDYYMUUJHLCGZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
1
Molar refractivity
38.97
TPSA
38.69
LogP / Solubility
WLOGP
0.42
MLOGP
0.36
XLogP3
-0.1
Consensus LogP
0.23
Log S (ESOL)
-0.69
Class (ESOL)
Very soluble
Log S (Ali)
-1.08
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)
-3.33
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
Safety & Transport
GHS Hazard Statements
Not Classified
Reported as not meeting GHS hazard criteria by 37 of 37 companies. For more detailed information, please visit ECHA C&L website.
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