CAS RN: 1160573-26-1
1-Bromo-5-chloro-2,3-difluorobenzene
Product Availability
Choose a grade to view its available package options.
3 package records3 with current stock1 grade group
- Product code: SSC-016149
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 0.1g, 0.25g, 1g, 5g, 10g, 25g
- Available purity: >97%
- Inventory rows with stock: 12
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 0.1g | -- | 2 In Stock | Beijing | Inquiry |
| 0.1g | >97% | 2 In Stock | Shenzhen | Inquiry |
| 0.25g | -- | 2 In Stock | Shanghai | Inquiry |
| 0.25g | >97% | 2 In Stock | Shanghai | Inquiry |
| 1g | -- | 2 In Stock | Beijing | Inquiry |
| 1g | >97% | 2 In Stock | Shenzhen | Inquiry |
| 5g | -- | 2 In Stock | Beijing | Inquiry |
| 5g | >97% | 2 In Stock | Shanghai | Inquiry |
| 10g | -- | 2 In Stock | Hong Kong | Inquiry |
| 10g | >97% | 2 In Stock | Beijing | Inquiry |
| 25g | -- | 2 In Stock | Beijing | Inquiry |
| 25g | >97% | 2 In Stock | Shenzhen | Inquiry |
1160573-26-1 / 1-bromo-5-chloro-2,3-difluorobenzene
1-Bromo-5-chloro-2,3-difluorobenzene | MFCD11845996 | 5-CHLORO-2,3-DIFLUOROBROMOBENZENE
Basic Information
CAS
1160573-26-1
Multi CAS
No
Molecular Formula
C6H2BrClF2
Molecular Weight
227.430000
Exact Mass
225.899650
SMILES
C1=C(C=C(C(=C1F)F)Br)Cl
InChI
InChI=1S/C6H2BrClF2/c7-4-1-3(8)2-5(9)6(4)10/h1-2H
InChIKey
QTGHEPDHRHJOGR-UHFFFAOYSA-N
Synonyms
1-Bromo-5-chloro-2,3-difluorobenzene
MFCD11845996
5-CHLORO-2,3-DIFLUOROBROMOBENZENE
SCHEMBL22165559
SCHEMBL29429741
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
H-bond acceptors
2
Molar refractivity
39.07
TPSA
0.0000
LogP / Solubility
WLOGP
3.38
MLOGP
2.98
XLogP3
3.4
Consensus LogP
3.25
Log S (ESOL)
-3.82
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.87
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.94
Class (SILICOS-IT)
Poorly 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)
-1.71
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
