CAS RN: 6000-00-6
METHYL 4-BROMOCROTONATE
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.20251112 | 250mg / 1g / 5g / 25g | Confirm by inquiry | Shandong, Shanghai | Inquiry |
- Product code: SSC-168584
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: 1g, 5g, 10g, 25g, 100g, 500g
- Available purity: >90%, >80%
- Inventory rows with stock: 6
- 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 |
|---|---|---|---|---|
| 1g | >90% | 5 In Stock | Hong Kong | Inquiry |
| 5g | >90% | 5 In Stock | Beijing | Inquiry |
| 10g | >90% | 5 In Stock | Shanghai | Inquiry |
| 5g | >80% | 4 In Stock | Shenzhen | Inquiry |
| 25g | >90% | 4 In Stock | Hong Kong | Inquiry |
| 100g | >90% | 2 In Stock | Shanghai | Inquiry |
| 10g | >80% | 0 Out of Stock | Shenzhen | Inquiry |
| 25g | >80% | 0 Out of Stock | Beijing | Inquiry |
| 100g | >80% | 0 Out of Stock | Shanghai | Inquiry |
| 500g | >80% | 0 Out of Stock | Beijing | Inquiry |
6000-00-6 / methyl 4-bromobut-2-enoate
Basic Information
CAS
6000-00-6
Multi CAS
Yes
Molecular Formula
C5H7BRO2
Molecular Weight
179.010000
Exact Mass
177.962940
InChI
InChI=1S/C5H7BrO2/c1-8-5(7)3-2-4-6/h2-3H,4H2,1H3
InChIKey
RWIKCBHOVNDESJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
8
Fraction Csp3
0.4
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
34.95
TPSA
26.3
LogP / Solubility
WLOGP
1.11
MLOGP
0.97
XLogP3
1.1
Consensus LogP
1.06
Log S (ESOL)
-1.52
Class (ESOL)
Soluble
Log S (Ali)
-1.83
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.99
Class (SILICOS-IT)
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)
-3.02
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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