CAS RN: 56909-02-5
6-Heptynoic acid methyl ester
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.20260130 | 50mg / 250mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS56909-02-5
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: 1g
- 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 |
|---|---|---|---|---|
| 1g | 95%+ | 0 Out of Stock | Beijing | Inquiry |
56909-02-5 / methyl hept-6-ynoate
Basic Information
CAS
56909-02-5
Multi CAS
No
Molecular Formula
C8H12O2
Molecular Weight
140.180000
Exact Mass
140.083730
InChI
InChI=1S/C8H12O2/c1-3-4-5-6-7-8(9)10-2/h1H,4-7H2,2H3
InChIKey
SIAYBFIHWUHVRJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
0.62
Rotatable bonds
4
H-bond acceptors
2
Molar refractivity
39.32
TPSA
26.3
LogP / Solubility
WLOGP
1.35
MLOGP
1.18
XLogP3
2
Consensus LogP
1.51
Log S (ESOL)
-1.3
Class (ESOL)
Soluble
Log S (Ali)
-1.69
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.17
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
Customers Also Viewed
-
-
-
-
-
1-[3-(4-METHYL-PIPERAZIN-1-YL)-PHENYL]-ETHANONE
- CAS RN: 56915-80-1
- Product Code: starshine_CAS56915-80-1
- Purity/Analytical method: >99.0%
-
![CAS 56910-98-6 Methyl benzo[c]isothiazole-4-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/56910-98-6.gif)
![CAS 56915-80-1 1-[3-(4-METHYL-PIPERAZIN-1-YL)-PHENYL]-ETHANONE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/56915-80-1.gif)
