![CAS 669066-98-2 Cyclopropanecarboxylic acid, 1-[(trifluoroacetyl)amino]- (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/669066-98-2.gif)
CAS RN: 669066-98-2
Cyclopropanecarboxylic acid, 1-[(trifluoroacetyl)amino]- (9CI)
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.20260601 | 50mg | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-176567
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: ＞97%
- 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 | ＞97% | 0 Out of Stock | Shanghai | Inquiry |
669066-98-2 / 1-[(2,2,2-trifluoroacetyl)amino]cyclopropane-1-carboxylic acid
Basic Information
CAS
669066-98-2
Multi CAS
No
Molecular Formula
C6F3H6NO3
Molecular Weight
197.110000
Exact Mass
197.029978
InChI
InChI=1S/C6H6F3NO3/c7-6(8,9)3(11)10-5(1-2-5)4(12)13/h1-2H2,(H,10,11)(H,12,13)
InChIKey
ZWFYYKVOJQHLTH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Fraction Csp3
0.67
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
33.8
TPSA
66.4
LogP / Solubility
WLOGP
0.28
MLOGP
0.25
XLogP3
0.6
Consensus LogP
0.38
Log S (ESOL)
-1.11
Class (ESOL)
Soluble
Log S (Ali)
-1.38
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.42
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)
-3.72
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
2-(2-Pyridinyl)-1H-benzimidazole-5-carboxylic acid
- CAS RN: 669070-64-8
- Product Code: starshine_CAS669070-64-8
- Purity/Analytical method: >99.0%
-
-
trans-ethyl 2-(4-((ethylaMino)Methyl)cyclohexyl)acetate
- CAS RN: 669080-89-1
- Product Code: SSC-176570
-
Acetamide, 2,2′-oxybis[N,N-bis(2-ethylhexyl)-
- CAS RN: 669087-46-1
- Product Code: starshine_CAS669087-46-1
- Purity/Analytical method: >99.0%
-
2-[Bis(3,5-dimethylphenyl)phosphino]benzaldehyde
- CAS RN: 669091-00-3
- Product Code: SSC-176580
-
Benzamide, N-(2-hydroxyphenyl)-3-methoxy-4-methyl- (9CI)
- CAS RN: 669091-09-2
- Product Code: SSC-176581
![CAS 669091-00-3 2-[Bis(3,5-dimethylphenyl)phosphino]benzaldehyde molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/669091-00-3.gif)
