![CAS 162107-49-5 Carbamic acid, [(1R)-1-(hydroxymethyl)-2-propynyl]-, 1,1-dimethylethyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/162107-49-5.gif)
CAS RN: 162107-49-5
Carbamic acid, [(1R)-1-(hydroxymethyl)-2-propynyl]-, 1,1-dimethylethyl ester
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.20251208 | 50mg / 100mg / 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-069643
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 |
162107-49-5 / tert-butyl N-[(2R)-1-hydroxybut-3-yn-2-yl]carbamate
Basic Information
CAS
162107-49-5
Multi CAS
No
Molecular Formula
C9H15NO3
Molecular Weight
185.220000
Exact Mass
185.105193
SMILES
CC(C)(C)OC(=O)N[C@@H](CO)C#C
InChI
InChI=1S/C9H15NO3/c1-5-7(6-11)10-8(12)13-9(2,3)4/h1,7,11H,6H2,2-4H3,(H,10,12)/t7-/m1/s1
InChIKey
LFPILXPLMVYREQ-SSDOTTSWSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Fraction Csp3
0.67
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
49.08
TPSA
58.56
LogP / Solubility
WLOGP
0.51
MLOGP
0.44
XLogP3
0.4
Consensus LogP
0.45
Log S (ESOL)
-1.17
Class (ESOL)
Soluble
Log S (Ali)
-1.44
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.52
Class (SILICOS-IT)
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)
-3.49
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
2
Customers Also Viewed
-
![CAS 162107-50-8 3-Butynoicacid,2-[[(1,1-dimethylethoxy)carbonyl]amino]-,(R)-(9CI) molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
3-Butynoicacid,2-[[(1,1-dimethylethoxy)carbonyl]amino]-,(R)-(9CI)
- CAS RN: 162107-50-8
- Product Code: SSC-069644
-
NEURODYE GH4-64
- CAS RN: 162112-35-8
- Product Code: starshine_CAS162112-35-8
- Purity/Analytical method: >99.0%
-
(S)-DIPHENYLALANINOL
- CAS RN: 162118-01-6
- Product Code: starshine_CAS162118-01-6
- Purity/Analytical method: >99.0%
-
Carbamic acid, [2-(hydroxymethyl)cyclopropyl]-, 1,1-dimethylethyl ester, (1R-
- CAS RN: 162129-49-9
- Product Code: SSC-069662
-
trans-cyclopropanecarboxylic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester
- CAS RN: 162129-55-7
- Product Code: SSC-069663
-
trans-2-Bocamino-cyclopropanecarboxylic acid ethyl ester
- CAS RN: 162129-60-4
- Product Code: SSC-069664
![CAS 162107-50-8 3-Butynoicacid,2-[[(1,1-dimethylethoxy)carbonyl]amino]-,(R)-(9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/162107-50-8.gif)
![CAS 162129-49-9 Carbamic acid, [2-(hydroxymethyl)cyclopropyl]-, 1,1-dimethylethyl ester, (1R- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/162129-49-9.gif)
![CAS 162129-55-7 trans-cyclopropanecarboxylic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/162129-55-7.gif)
