CAS RN: 14235-81-5
4-Ethynylaniline
Product Availability
Choose a grade to view its available package options.
17 package records16 with current stock4 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250906 | 10g | In stock | Shanghai, Shandong, Guangdong | Inquiry | |
| Batchno.20250713 | 1g | In stock | Shanghai, Shandong, Guangdong, Chongqing | Inquiry | |
| Batchno.20251207 | 250g | In stock | Shanghai | Inquiry | |
| Batchno.20250709 | 50g | In stock | Shanghai, Shandong | Inquiry | |
| Batchno.20260106 | 5g | In stock | Shanghai, Shandong, Hebei | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250821 | 100g | In stock | Shanghai, Tianjin | Inquiry | |
| Batchno.20260421 | 10g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20260129 | 1g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20250528 | 1kg | In stock | Shanghai | Inquiry | |
| Batchno.20250122 | 250mg | In stock | Shanghai, Shenzhen, Tianjin | Inquiry | |
| Batchno.20260516 | 25g | In stock | Shanghai, Shenzhen, Tianjin | Inquiry | |
| Batchno.20260412 | 500g | In stock | Shanghai | Inquiry | |
| Batchno.20250704 | 5g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250227 | 1g | In stock | Shanghai | Inquiry |
- Product code: SSC-053211
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
- Available purity: ≥98%
- Inventory rows with stock: 2
- 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 | ≥98% | 5 In Stock | Shanghai | Inquiry |
| 5g | ≥98% | 4 In Stock | Beijing | Inquiry |
| 10g | ≥98% | 0 Out of Stock | Beijing | Inquiry |
| 25g | ≥98% | 0 Out of Stock | Beijing | Inquiry |
| 100g | ≥98% | 0 Out of Stock | Shanghai | Inquiry |
14235-81-5 / 4-ethynylaniline
Basic Information
CAS
14235-81-5
Multi CAS
No
Molecular Formula
C8H7N
Molecular Weight
117.150000
Exact Mass
117.057849
SMILES
C#CC1=CC=C(C=C1)N
InChI
InChI=1S/C8H7N/c1-2-7-3-5-8(9)6-4-7/h1,3-6H,9H2
InChIKey
JXYITCJMBRETQX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
38.79
TPSA
26.02
LogP / Solubility
WLOGP
1.25
MLOGP
1.09
XLogP3
1.3
Consensus LogP
1.21
Log S (ESOL)
-1.85
Class (ESOL)
Soluble
Log S (Ali)
-1.42
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.46
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)
-2.55
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
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
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