CAS RN: 944818-98-8
2-Propyn-1-amine, 3-(4-chlorophenyl)-
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.20251009 | 100mg / 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-209370
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 | Shanghai | Inquiry |
944818-98-8 / 3-(4-chlorophenyl)prop-2-yn-1-amine
Basic Information
CAS
944818-98-8
Multi CAS
No
Molecular Formula
C9H8CLN
Molecular Weight
165.620000
Exact Mass
165.034527
InChI
InChI=1S/C9H8ClN/c10-9-5-3-8(4-6-9)2-1-7-11/h3-6H,7,11H2
InChIKey
RFZDTNABXXXMAJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.11
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
47.38
TPSA
26.02
LogP / Solubility
WLOGP
1.65
MLOGP
1.45
XLogP3
1.8
Consensus LogP
1.63
Log S (ESOL)
-2.31
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.11
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.11
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)
-2.56
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
-
Isodaphnoretin B
- CAS RN: 944824-29-7
- Product Code: starshine_CAS944824-29-7
- Purity/Analytical method: >99.0%
-
Oxazole, 4-cyclohexyl-2-[2-(diphenylphosphino)phenyl]-4,5-dihydro-, (4R)-
- CAS RN: 944836-02-6
- Product Code: SSC-209373
-
(4S)-2-[2-[Bis[4-(trifluoromethyl)phenyl]phosphino]-5-(trifluoromethyl)phenyl]-4-tert-butyl-4,5-dihydrooxazole
- CAS RN: 944836-22-0
- Product Code: SSC-209375
-
Decernotinib
- CAS RN: 944842-54-0
- Product Code: starshine_CAS944842-54-0
- Purity/Analytical method: >99.0%
-
6-(1-pyrrolidinyl)-1,3-benzothiazol-2-amine(SALTDATA: FREE)
- CAS RN: 944887-42-7
- Product Code: SSC-209383
-
![CAS 944836-02-6 Oxazole, 4-cyclohexyl-2-[2-(diphenylphosphino)phenyl]-4,5-dihydro-, (4R)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/944836-02-6.gif)
![CAS 944836-22-0 (4S)-2-[2-[Bis[4-(trifluoromethyl)phenyl]phosphino]-5-(trifluoromethyl)phenyl]-4-tert-butyl-4,5-dihydrooxazole molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/944836-22-0.gif)
