![CAS 4836-00-4 syn-2-Nitrobenzaldoxime [Deprotecting Agent] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/n0486-jpgcontextbwfzdgvyfhjvb3r8mzi1otl8aw1hz2uvanblz3xoyzavadvklzg5mze2odyznta4nzgvtja0odyuanbnfdywy2u0nzzkyjeymti0ztrjzwmznmq2ytaxmzblmmuzyzu5ote1mjuzmmzmztbmmzgxmdiznzbjowjknji0owu.jpeg)
CAS RN: 4836-00-4
syn-2-Nitrobenzaldoxime [Deprotecting Agent]
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.20250715 | 1g | In stock | Shanghai | Inquiry |
- Product code: SSC-155195
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 25g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 25g | ≥95% | 0 Out of Stock | Shanghai | Inquiry |
4836-00-4 / N-[(2-nitrophenyl)methylidene]hydroxylamine
Basic Information
CAS
4836-00-4
Multi CAS
Yes
Molecular Formula
C7H6N2O3
Molecular Weight
166.130000
Exact Mass
166.037842
InChI
InChI=1S/C7H6N2O3/c10-8-5-6-3-1-2-4-7(6)9(11)12/h1-5,10H
InChIKey
IHMGDCCTWRRUDX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
42.48
TPSA
75.73
LogP / Solubility
WLOGP
1.4
MLOGP
1.23
XLogP3
2
Consensus LogP
1.54
Log S (ESOL)
-1.99
Class (ESOL)
Soluble
Log S (Ali)
-1.94
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.14
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)
-2.74
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
