CAS RN: 225920-04-7
(R)-1-(4-Ethoxyophenyl)ethanol
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.20260620 | 5g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS225920-04-7
- Purity/Analytical Methods: >99.0%
225920-04-7 / 1-(4-ethoxyphenyl)ethanol
Basic Information
CAS
225920-04-7
Multi CAS
No
Molecular Formula
C10H14O2
Molecular Weight
166.220000
Exact Mass
166.099380
SMILES
CCOC1=CC=C(C=C1)C(C)O
InChI
InChI=1S/C10H14O2/c1-3-12-10-6-4-9(5-7-10)8(2)11/h4-8,11H,3H2,1-2H3/t8-/m1/s1
InChIKey
GKGQWBJLOYXULB-MRVPVSSYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
48.24
TPSA
29.46
LogP / Solubility
WLOGP
2.14
MLOGP
1.88
XLogP3
1.8
Consensus LogP
1.94
Log S (ESOL)
-2.39
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.47
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.88
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)
-2.22
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
-
(1,5-Cyclooctadiene)bis(triMethylsilylMethyl)palladiuM(II)
- CAS RN: 225931-80-6
- Product Code: SSC-110393
-
-
-
-
