CAS RN: 35166-78-0
CYCLOHEXYLMETHYLMAGNESIUM BROMIDE
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.20260118 | 100ml | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS35166-78-0
- Purity/Analytical Methods: >99.0%
35166-78-0 / magnesium;methanidylcyclohexane;bromide
Basic Information
CAS
35166-78-0
Multi CAS
Yes
Molecular Formula
C7H13BRMG
Molecular Weight
201.390000
Exact Mass
200.005100
InChI
InChI=1S/C7H13.BrH.Mg/c1-7-5-3-2-4-6-7;;/h7H,1-6H2;1H;/q-1;;+2/p-1
InChIKey
UFQSTBGEWZUCBQ-UHFFFAOYSA-M
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
0.86
H-bond acceptors
2
Molar refractivity
37.69
TPSA
0.0000
LogP / Solubility
WLOGP
-0.98
MLOGP
-0.86
XLogP3
-0.98
Consensus LogP
-0.94
Log S (ESOL)
-0.47
Class (ESOL)
Very soluble
Log S (Ali)
-0.51
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.16
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
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)
-4.64
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
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