CAS RN: 593-96-4
1-BROMO-1-CHLOROETHANE
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250906 | 100mg / 250mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS593-96-4
- Purity/Analytical Methods: >99.0%
593-96-4 / 1-bromo-1-chloroethane
Basic Information
CAS
593-96-4
Multi CAS
No
Molecular Formula
C2H4BRCL
Molecular Weight
143.410000
Exact Mass
141.918490
InChI
InChI=1S/C2H4BrCl/c1-2(3)4/h2H,1H3
InChIKey
QMSVNDSDEZTYAS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
4
Fraction Csp3
1
Molar refractivity
24.24
TPSA
0.0000
LogP / Solubility
WLOGP
1.97
MLOGP
1.72
XLogP3
2.1
Consensus LogP
1.93
Log S (ESOL)
-1.97
Class (ESOL)
Soluble
Log S (Ali)
-2.16
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.22
Class (SILICOS-IT)
Moderately 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)
-2.2
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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