CAS RN: 51762-67-5
3-Nitrophthalonitrile
Product Availability
Choose a grade to view its available package options.
6 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250904 | 100g | In stock | Shanghai, Shenzhen, Tianjin, Chengdu | Inquiry |
| Batchno.20250703 | 10g | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20251128 | 1kg | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20250203 | 25g | In stock | Shanghai, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250703 | 500g | In stock | Shanghai, Tianjin, Chengdu | Inquiry |
| Batchno.20251005 | 5g | In stock | Shanghai, Wuhan | Inquiry |
- Product code: SSC-158710
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: 5g, 10g, 25g, 100g, 1g, 500g
- Available purity: ≥98%
- Inventory rows with stock: 5
- 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 |
|---|---|---|---|---|
| 5g | ≥98% | 5 In Stock | Shenzhen | Inquiry |
| 10g | ≥98% | 5 In Stock | Shenzhen | Inquiry |
| 25g | ≥98% | 5 In Stock | Shenzhen | Inquiry |
| 100g | ≥98% | 5 In Stock | Shenzhen | Inquiry |
| 1g | ≥98% | 1 In Stock | Hong Kong | Inquiry |
| 500g | ≥98% | 0 Out of Stock | Shanghai | Inquiry |
51762-67-5 / 3-nitrobenzene-1,2-dicarbonitrile
Basic Information
CAS
51762-67-5
Multi CAS
Yes
Molecular Formula
C8H3N3O2
Molecular Weight
173.130000
Exact Mass
173.022526
InChI
InChI=1S/C8H3N3O2/c9-4-6-2-1-3-8(11(12)13)7(6)5-10/h1-3H
InChIKey
UZJZIZFCQFZDHP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
42.53
TPSA
90.72
LogP / Solubility
WLOGP
1.34
MLOGP
1.17
XLogP3
0.7
Consensus LogP
1.07
Log S (ESOL)
-2.03
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.95
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.02
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.83
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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cis-1,2-Dicyano-1,2-bis(2,4,5-trimethyl-3-thienyl)ethene
- CAS RN: 112440-46-7
- Product Code: ICTB1536
- Purity/Analytical method: >98.0%(N)
