CAS RN: 949-06-4
5-CHLORO-1-(4-METHOXYPHENYL)-1-OXOPENTANE
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.20250802 | 100mg / 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-210092
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 5g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 5g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
949-06-4 / 5-chloro-1-(4-methoxyphenyl)pentan-1-one
Basic Information
CAS
949-06-4
Multi CAS
Yes
Molecular Formula
C12H15CLO2
Molecular Weight
226.700000
Exact Mass
226.076057
InChI
InChI=1S/C12H15ClO2/c1-15-11-7-5-10(6-8-11)12(14)4-2-3-9-13/h5-8H,2-4,9H2,1H3
InChIKey
YYSTYNWZWNOXOQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.42
Rotatable bonds
6
H-bond acceptors
2
Molar refractivity
61.9
TPSA
26.3
LogP / Solubility
WLOGP
3.29
MLOGP
2.9
XLogP3
2.8
Consensus LogP
3
Log S (ESOL)
-3.22
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.79
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.58
Class (SILICOS-IT)
Slightly 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)
-1.77
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
1-benzyl-4-piperidone oxime
- CAS RN: 949-69-9
- Product Code: starshine_CAS949-69-9
- Purity/Analytical method: >99.0%
-
-
1H-SPIRO[CYCLOHEXANE-1,2-QUINAZOLIN]-4(3H)-ONE
- CAS RN: 950-31-2
- Product Code: starshine_CAS950-31-2
- Purity/Analytical method: >99.0%
-
-
-
![CAS 950-31-2 1H-SPIRO[CYCLOHEXANE-1,2-QUINAZOLIN]-4(3H)-ONE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/950-31-2.gif)
