CAS RN: 6332-83-8
2-(4-CHLOROPHENYL)-1-PHENYLETHANONE
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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: 1g, 0.1g, 0.25g, 5g
- Available purity: ≥95%
- Inventory rows with stock: 3
- Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 6332-83-8
| Pack Size |
Recorded Purity |
Available Qty |
Ship From |
Inquiry |
| 1g |
≥95% |
5
In Stock
|
Shenzhen |
Inquiry |
| 0.1g |
≥95% |
1
In Stock
|
Beijing |
Inquiry |
| 0.25g |
≥95% |
1
In Stock
|
Shanghai |
Inquiry |
| 5g |
≥95% |
0
Out of Stock
|
Hong Kong |
Inquiry |
6332-83-8 / 2-(4-chlorophenyl)-1-phenylethanone
Standard CAS: 6332-83-8
Multi CAS: Yes
Basic Information
CAS
6332-83-8
Multi CAS
Yes
Molecular Formula
C14H11CLO
Molecular Weight
230.690000
Exact Mass
230.049843
InChI
InChI=1S/C14H11ClO/c15-13-8-6-11(7-9-13)10-14(16)12-4-2-1-3-5-12/h1-9H,10H2
InChIKey
HGIDMJOUQKOWMX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
12
Fraction Csp3
0.07
Rotatable bonds
3
H-bond acceptors
1
Molar refractivity
65.93
TPSA
17.07
LogP / Solubility
WLOGP
3.77
MLOGP
3.32
XLogP3
3.8
Consensus LogP
3.63
Log S (ESOL)
-4
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.17
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.64
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.45
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5