CAS RN: 1109284-40-3
(1S,6R)-6-AMINO-2,2-DIFLUOROCYCLOHEXAN-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.20251127 | 100mg / 250mg / 1g / 5g / 25g | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-011843
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 | Beijing | Inquiry |
1109284-40-3 / cis-(1S,6R)-6-amino-2,2-difluorocyclohexan-1-ol
(1S,6R)-6-amino-2,2-difluorocyclohexanol | (1S,6R)-6-amino-2,2-difluorocyclohexan-1-ol | MFCD22419898
Basic Information
CAS
1109284-40-3
Multi CAS
Yes
Molecular Formula
C6H11F2NO
Molecular Weight
151.150000
Exact Mass
151.080870
SMILES
C1C[C@H]([C@@H](C(C1)(F)F)O)N
InChI
InChI=1S/C6H11F2NO/c7-6(8)3-1-2-4(9)5(6)10/h4-5,10H,1-3,9H2/t4-,5+/m1/s1
InChIKey
YELVGYMNGIHCKI-UHNVWZDZSA-N
Synonyms
(1S,6R)-6-amino-2,2-difluorocyclohexanol
(1S,6R)-6-amino-2,2-difluorocyclohexan-1-ol
MFCD22419898
rac-(1R,6S)-6-amino-2,2-difluorocyclohexan-1-ol
SCHEMBL1691466
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
32.78
TPSA
46.25
LogP / Solubility
WLOGP
0.49
MLOGP
0.43
XLogP3
0.3
Consensus LogP
0.41
Log S (ESOL)
-1.09
Class (ESOL)
Soluble
Log S (Ali)
-1.16
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.05
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)
-3.29
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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