![CAS 605-88-9 2-methylbenzo[h]quinoline molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/605-88-9.gif)
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, 0.25g, 1g, 5g, 10g
- Available purity: ≥97%
- Inventory rows with stock: 10
- 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 |
|---|---|---|---|---|
| 0.1g | -- | 5 In Stock | Hong Kong | Inquiry |
| 0.1g | ≥97% | 5 In Stock | Shanghai | Inquiry |
| 0.25g | -- | 5 In Stock | Hong Kong | Inquiry |
| 0.25g | ≥97% | 2 In Stock | Beijing | Inquiry |
| 1g | -- | 2 In Stock | Hong Kong | Inquiry |
| 1g | ≥97% | 2 In Stock | Beijing | Inquiry |
| 5g | -- | 1 In Stock | Hong Kong | Inquiry |
| 5g | ≥97% | 1 In Stock | Shanghai | Inquiry |
| 10g | -- | 1 In Stock | Shenzhen | Inquiry |
| 10g | ≥97% | 1 In Stock | Shenzhen | Inquiry |
605-88-9 / 2-methylbenzo[h]quinoline
Basic Information
CAS
605-88-9
Multi CAS
Yes
Molecular Formula
C14H11N
Molecular Weight
193.240000
Exact Mass
193.089149
InChI
InChI=1S/C14H11N/c1-10-6-7-12-9-8-11-4-2-3-5-13(11)14(12)15-10/h2-9H,1H3
InChIKey
NFXIDKHEPSPXNF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
14
Fraction Csp3
0.07
H-bond acceptors
1
Molar refractivity
63.99
TPSA
12.89
LogP / Solubility
WLOGP
3.7
MLOGP
3.25
XLogP3
3.8
Consensus LogP
3.58
Log S (ESOL)
-4.06
Class (ESOL)
Slightly soluble
Log S (Ali)
-3.81
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.98
Class (SILICOS-IT)
Poorly 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)
-1.27
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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