CAS RN: 100820-43-7
7-NITRO-2,3-DIHYDRO-1H-INDOLE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250726 | 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-001551
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: 0.25g, 0.1g, 1g, 10g, 5g, 25g
- Available purity: ≥95%
- 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 |
|---|---|---|---|---|
| 0.25g | ≥95% | 3 In Stock | Hong Kong | Inquiry |
| 0.1g | ≥95% | 2 In Stock | Shanghai | Inquiry |
| 1g | ≥95% | 2 In Stock | Beijing | Inquiry |
| 10g | ≥95% | 2 In Stock | Shenzhen | Inquiry |
| 5g | ≥95% | 1 In Stock | Shanghai | Inquiry |
| 25g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
100820-43-7 / 7-nitro-2,3-dihydro-1H-indole
7-NITRO-2,3-DIHYDRO-1H-INDOLE | DTXSID90543976 | RefChem:311117
Basic Information
CAS
100820-43-7
Multi CAS
No
Molecular Formula
C8H8N2O2
Molecular Weight
164.160000
Exact Mass
164.058578
SMILES
C1CNC2=C1C=CC=C2[N+](=O)[O-]
InChI
InChI=1S/C8H8N2O2/c11-10(12)7-3-1-2-6-4-5-9-8(6)7/h1-3,9H,4-5H2
InChIKey
MSVCQAUKLQEIJJ-UHFFFAOYSA-N
Synonyms
7-NITRO-2,3-DIHYDRO-1H-INDOLE
DTXSID90543976
RefChem:311117
DTXCID80494761
895-867-2
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
45.29
TPSA
55.17
LogP / Solubility
WLOGP
1.56
MLOGP
1.37
XLogP3
1.8
Consensus LogP
1.58
Log S (ESOL)
-2.15
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.03
Class (Ali)
Moderately 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)
-2.61
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Customers Also Viewed
-
1H-Indole-3-carboxylic acid, 6-Methyl-, ethyl ester
- CAS RN: 100821-48-5
- Product Code: SSC-001552
-
1H-INDOLE-3-CARBOXYLIC ACID, 6-CHLORO-,ETHYL ESTER
- CAS RN: 100821-50-9
- Product Code: SSC-001553
-
1H-Isoindole-1,3(2H)-dione, 5-amino-2-[2,6-bis(1-methylethyl)phenyl]-
- CAS RN: 100823-03-8
- Product Code: starshine_CAS100823-03-8
- Purity/Analytical method: >99.0%
-
-
4-BroMoanisole-d3
- CAS RN: 100835-59-4
- Product Code: starshine_CAS100835-59-4
- Purity/Analytical method: >99.0%
-
![CAS 100823-03-8 1H-Isoindole-1,3(2H)-dione, 5-amino-2-[2,6-bis(1-methylethyl)phenyl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/100823-03-8.gif)
