CAS RN: 2095408-94-7
Morpholine, 2-(difluoromethyl)-, hydrochloride
- Product code: SSC-099316
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 | Shanghai | Inquiry |
2095408-94-7 / 2-(difluoromethyl)morpholine;hydrochloride
Basic Information
CAS
2095408-94-7
Multi CAS
No
Molecular Formula
C5H10ClF2NO
Molecular Weight
173.590000
Exact Mass
173.041898
SMILES
C1COC(CN1)C(F)F.Cl
InChI
InChI=1S/C5H9F2NO.ClH/c6-5(7)4-3-8-1-2-9-4;/h4-5,8H,1-3H2;1H
InChIKey
QDWKZGSDPAPRRX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
35.86
TPSA
21.26
LogP / Solubility
WLOGP
0.66
MLOGP
0.58
XLogP3
0.66
Consensus LogP
0.63
Log S (ESOL)
-1.27
Class (ESOL)
Soluble
Log S (Ali)
-1.46
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.46
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)
-3.31
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
-
![CAS 2095409-78-0 2-Oxaspiro[3.3]heptane-6-carboxylic acid, sodium salt (1:1) molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
2-Oxaspiro[3.3]heptane-6-carboxylic acid, sodium salt (1:1)
- CAS RN: 2095409-78-0
- Product Code: SSC-099326
-
Carbamic acid, N-(3-aminocyclohexyl)-, 1,1-dimethylethyl ester, hydrochloride (1:1)
- CAS RN: 2095410-88-9
- Product Code: starshine_CAS2095410-88-9
- Purity/Analytical method: >99.0%
-
3-(1H-pyrazol-4-yl)piperidine dihydrochloride
- CAS RN: 2095410-90-3
- Product Code: SSC-099339
-
2-thia-6-azaspiro[3.4]octane 2,2-dioxide hydrochloride
- CAS RN: 2095411-01-9
- Product Code: SSC-099340
-
3′-Azido-3′-deoxy-beta-L-uridine
- CAS RN: 2095417-28-8
- Product Code: starshine_CAS2095417-28-8
- Purity/Analytical method: >99.0%
-
5′-O-(4,4′-Dimethoxytrityl)-5-methoxyuridine
- CAS RN: 2095417-73-3
- Product Code: SSC-099347
![CAS 2095409-78-0 2-Oxaspiro[3.3]heptane-6-carboxylic acid, sodium salt (1:1) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2095409-78-0.png)
![CAS 2095411-01-9 2-thia-6-azaspiro[3.4]octane 2,2-dioxide hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2095411-01-9.png)
