CAS RN: 90350-25-7
2-BroMo-1-chloro-4-isopropylbenzene
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260211 | 100mg | In stock | Shenzhen | Inquiry |
| Batchno.20251012 | 100mg / 250mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
| Batchno.20260316 | 1g | Out of stock | Inquiry | |
| Batchno.20260301 | 250mg | In stock | Shenzhen, Tianjin | Inquiry |
| Batchno.20260622 | 5g | In stock | Shenzhen, Chengdu | Inquiry |
- Product code: starshine_CAS90350-25-7
- Purity/Analytical Methods: >99.0%
90350-25-7 / 2-bromo-1-chloro-4-propan-2-ylbenzene
Basic Information
CAS
90350-25-7
Multi CAS
No
Molecular Formula
C9H10BRCL
Molecular Weight
233.530000
Exact Mass
231.965440
InChI
InChI=1S/C9H10BrCl/c1-6(2)7-3-4-9(11)8(10)5-7/h3-6H,1-2H3
InChIKey
NSVFYXVTWMTRCY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
1
Molar refractivity
53.24
TPSA
0.0000
LogP / Solubility
WLOGP
4.23
MLOGP
3.72
XLogP3
4.4
Consensus LogP
4.12
Log S (ESOL)
-4.29
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.53
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.81
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.14
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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