CAS RN: 103878-58-6
5-Bromothiazole-4-carboxylic acid
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.20250420 | 1g | In stock | Shanghai | Inquiry |
- Product code: SSC-005523
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, 0.25g, 10g, 5g, 25g, 100g
- Available purity: ≥96%
- Inventory rows with stock: 3
- 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 | ≥96% | 5 In Stock | Hong Kong | Inquiry |
| 0.25g | ≥96% | 2 In Stock | Hong Kong | Inquiry |
| 10g | ≥96% | 1 In Stock | Shenzhen | Inquiry |
| 5g | ≥96% | 0 Out of Stock | Shenzhen | Inquiry |
| 25g | ≥96% | 0 Out of Stock | Shenzhen | Inquiry |
| 100g | ≥96% | 0 Out of Stock | Hong Kong | Inquiry |
103878-58-6 / 5-bromo-1,3-thiazole-4-carboxylic acid
5-bromo-1,3-thiazole-4-carboxylic acid | DTXSID70612119 | RefChem:301399
Basic Information
CAS
103878-58-6
Multi CAS
Yes
Molecular Formula
C4H2BrNO2S
Molecular Weight
208.040000
Exact Mass
206.898960
SMILES
C1=NC(=C(S1)Br)C(=O)O
InChI
InChI=1S/C4H2BrNO2S/c5-3-2(4(7)8)6-1-9-3/h1H,(H,7,8)
InChIKey
AZYQIQWMHMYDPO-UHFFFAOYSA-N
Synonyms
5-bromo-1,3-thiazole-4-carboxylic acid
DTXSID70612119
RefChem:301399
DTXCID40562874
639-268-4
Computed Properties
Structural Parameters
Heavy atom count
9
Aromatic heavy atom count
5
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
36.77
TPSA
50.19
LogP / Solubility
WLOGP
1.6
MLOGP
1.41
XLogP3
1.8
Consensus LogP
1.6
Log S (ESOL)
-2.49
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.42
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.46
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)
-2.85
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
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