CAS RN: 24165-60-4
4-(4-METHYOXY)PHENYL-1-BUTEN-4-OL 97
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.20260422 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS24165-60-4
- Purity/Analytical Methods: >99.0%
24165-60-4 / 1-(4-methoxyphenyl)but-3-en-1-ol
Basic Information
CAS
24165-60-4
Multi CAS
No
Molecular Formula
C11H14O2
Molecular Weight
178.230000
Exact Mass
178.099380
SMILES
COC1=CC=C(C=C1)C(CC=C)O
InChI
InChI=1S/C11H14O2/c1-3-4-11(12)9-5-7-10(13-2)8-6-9/h3,5-8,11-12H,1,4H2,2H3
InChIKey
JRKLDYQREJAUNQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.27
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
1
Molar refractivity
52.77
TPSA
29.46
LogP / Solubility
WLOGP
2.3
MLOGP
2.03
XLogP3
2.1
Consensus LogP
2.14
Log S (ESOL)
-2.47
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.69
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.21
Class (SILICOS-IT)
Poorly 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)
-2.17
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
Customers Also Viewed
-
4-CYANO-N,N-DIMETHYLBENZAMIDE
- CAS RN: 24167-50-8
- Product Code: starshine_CAS24167-50-8
- Purity/Analytical method: >99.0%
-
-
-
-
-
Miconazole EP Impurity I
- CAS RN: 24169-00-4
- Product Code: starshine_CAS24169-00-4
- Purity/Analytical method: >99.0%
