![CAS 67081-98-5 1-[4-(TRIFLUOROMETHYL)PHENYL]PROPAN-1-OL molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/67081-98-5.gif)
CAS RN: 67081-98-5
1-[4-(TRIFLUOROMETHYL)PHENYL]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.20260417 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-176731
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
67081-98-5 / 1-[4-(trifluoromethyl)phenyl]propan-1-ol
Basic Information
CAS
67081-98-5
Multi CAS
No
Molecular Formula
C10F3H11O
Molecular Weight
204.190000
Exact Mass
204.076199
InChI
InChI=1S/C10H11F3O/c1-2-9(14)7-3-5-8(6-4-7)10(11,12)13/h3-6,9,14H,2H2,1H3
InChIKey
DSPWVWRWAPFFNC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
46.69
TPSA
20.23
LogP / Solubility
WLOGP
3.15
MLOGP
2.77
XLogP3
2.8
Consensus LogP
2.91
Log S (ESOL)
-3.27
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.51
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.84
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)
-1.73
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
-
1-[4-(4-Chlorophenyl)-2-hydroxylbutyl]imidazole
- CAS RN: 67085-11-4
- Product Code: SSC-176734
-
2-(4-methylphenyl)-1,3-thiazolane
- CAS RN: 67086-82-2
- Product Code: starshine_CAS67086-82-2
- Purity/Analytical method: >99.0%
-
bis(1-methyl-1H-pyrazol-4-yl)methanone
- CAS RN: 67088-78-2
- Product Code: starshine_CAS67088-78-2
- Purity/Analytical method: >99.0%
-
L-2,2-DiMethylthiazolidine-4-carboxylic Acid Hydrochloride
- CAS RN: 67089-92-3
- Product Code: SSC-176737
-
![CAS 67085-11-4 1-[4-(4-Chlorophenyl)-2-hydroxylbutyl]imidazole molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/67085-11-4.gif)
