CAS RN: 116632-14-5
2-Amino-3-iodonaphthalene
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251028 | 100mg | In stock | Shanghai, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20251007 | 100mg / 250mg / 1g / 5g | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20250407 | 1g | In stock | Shanghai, Shenzhen | Inquiry | |
| Batchno.20251222 | 250mg | In stock | Shanghai, Shenzhen | Inquiry | |
| Batchno.20250410 | 5g | In stock | Shanghai | Inquiry |
- Product code: SSC-016569
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: 0.1g, 5g, 0.25g, 1g
- Available purity: >95%
- 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.
116632-14-5 / 3-iodonaphthalen-2-amine
2-AMINO-3-IODONAPHTHALENE | DTXSID50465524 | RefChem:255380
Basic Information
CAS
116632-14-5
Multi CAS
No
Molecular Formula
C10H8IN
Molecular Weight
269.080000
Exact Mass
268.970150
SMILES
C1=CC=C2C=C(C(=CC2=C1)N)I
InChI
InChI=1S/C10H8IN/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-6H,12H2
InChIKey
KAOTXIGLMDOHJJ-UHFFFAOYSA-N
Synonyms
2-AMINO-3-IODONAPHTHALENE
DTXSID50465524
RefChem:255380
DTXCID40416343
3-iodonaphthalen-2-amine
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
10
H-bond acceptors
1
H-bond donors
1
Molar refractivity
61.08
TPSA
26.02
LogP / Solubility
WLOGP
3.03
MLOGP
2.67
XLogP3
3.1
Consensus LogP
2.93
Log S (ESOL)
-4.03
Class (ESOL)
Slightly soluble
Log S (Ali)
-3.95
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.92
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.21
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
