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CAS RN: 130-00-7
Benzo[cd]indol-2(1H)-one
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.20250827 | 25g / 100g / 500g / 2.5kg | Confirm by inquiry | Shanghai, Chongqing, Shandong | Inquiry |
- Product code: SSC-036732
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: 25g, 5g, 100g, 500g, 1000g
- Available purity: ≥95%
- Inventory rows with stock: 3
- 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 |
|---|---|---|---|---|
| 25g | ≥95% | 5 In Stock | Beijing | Inquiry |
| 5g | ≥95% | 4 In Stock | Hong Kong | Inquiry |
| 100g | ≥95% | 3 In Stock | Shanghai | Inquiry |
| 500g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
| 1000g | ≥95% | 0 Out of Stock | Shanghai | Inquiry |
130-00-7 / 1H-benzo[cd]indol-2-one
Basic Information
CAS
130-00-7
Multi CAS
No
Molecular Formula
C11H7NO
Molecular Weight
169.180000
Exact Mass
169.052764
SMILES
C1=CC2=C3C(=C1)C(=O)NC3=CC=C2
InChI
InChI=1S/C11H7NO/c13-11-8-5-1-3-7-4-2-6-9(12-11)10(7)8/h1-6H,(H,12,13)
InChIKey
GPYLCFQEKPUWLD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
10
H-bond acceptors
1
H-bond donors
1
Molar refractivity
51.9
TPSA
29.1
LogP / Solubility
WLOGP
2.41
MLOGP
2.11
XLogP3
2.1
Consensus LogP
2.21
Log S (ESOL)
-2.97
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.68
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.76
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.04
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (91.7%): Harmful if swallowed [Warning Acute toxicity, oral]
H319 (10.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501
