CAS RN: 1122-91-4
4-Bromobenzaldehyde
Product Availability
Choose a grade to view its available package options.
6 package records6 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260612 | 5g / 25g / 100g / 500g / 2.5kg / 10kg | Confirm by inquiry | Shanghai, Shandong, Hebei, Guangdong, Chongqing | 5-7 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250109 | 1g | In stock | Shanghai, Shandong | Inquiry |
- Product code: SSC-012682
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: 25g, 100g, 500g, 1000g, 5000g, 10000g
- Available purity: ≥98%
- Inventory rows with stock: 4
- 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 |
|---|---|---|---|---|
| 25g | ≥98% | 5 In Stock | Beijing | Inquiry |
| 100g | ≥98% | 5 In Stock | Hong Kong | Inquiry |
| 500g | ≥98% | 4 In Stock | Beijing | Inquiry |
| 1000g | ≥98% | 1 In Stock | Shanghai | Inquiry |
| 5000g | ≥98% | 0 Out of Stock | Shenzhen | Inquiry |
| 10000g | ≥98% | 0 Out of Stock | Beijing | Inquiry |
1122-91-4 / 4-bromobenzaldehyde
BENZOYL BROMIDE | E79YZ864U3 | DTXSID7060677
Basic Information
CAS
1122-91-4
Multi CAS
Yes
Molecular Formula
C7H5BrO
Molecular Weight
185.020000
Exact Mass
183.952380
SMILES
C1=CC(=CC=C1C=O)Br
InChI
InChI=1S/C7H5BrO/c8-7-3-1-6(5-9)2-4-7/h1-5H
InChIKey
ZRYZBQLXDKPBDU-UHFFFAOYSA-N
Synonyms
BENZOYL BROMIDE
E79YZ864U3
DTXSID7060677
RefChem:118770
DTXCID1043128
Physical Properties
Physical Description
White crystalline powder
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
9
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
39.53
TPSA
17.07
LogP / Solubility
WLOGP
2.26
MLOGP
1.99
XLogP3
2.2
Consensus LogP
2.15
Log S (ESOL)
-2.84
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.71
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.86
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)
-2.24
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
Safety & Transport
Pictogram(s)
Irritant
Health Hazard
Signal
Danger
GHS Hazard Statements
H302 (73.1%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (98.7%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (98.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H334 (48.7%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]
H335 (94.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P233, P260, P261, P264, P264+P265, P270, P271, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501
