CAS RN: 354-51-8
1,2-Dibromo-1-chloro-1,2,2-trifluoroethane
Product Availability
Choose a grade to view its available package options.
5 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250913 | 1g / 5g / 25g | Confirm by inquiry | Shanghai | 5-7 business days | Inquiry |
- Product code: ICTD2220
354-51-8 / 1,2-dibromo-1-chloro-1,2,2-trifluoroethane
Basic Information
CAS
354-51-8
Multi CAS
No
Molecular Formula
C2BR2CLF3
Molecular Weight
276.280000
Exact Mass
275.798690
InChI
InChI=1S/C2Br2ClF3/c3-1(5,6)2(4,7)8
InChIKey
OVZATIUQXBLIQT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
8
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
32.49
TPSA
0.0000
LogP / Solubility
WLOGP
3.23
MLOGP
2.85
XLogP3
3.5
Consensus LogP
3.19
Log S (ESOL)
-3.52
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.16
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.26
Class (SILICOS-IT)
Slightly 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)
-2.11
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2
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