![CAS 114214-49-2 tert-Butyl 6-Oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b5385-jpgcontextbwfzdgvyfhjvb3r8mzaxntl8aw1hz2uvanblz3xomdavadu2lzg5mjkxotg5mze5otgvqjuzoduuanbnfgnjnta2otnlzgjhoduynzq3ntnjn2m4zgqxnjdknzdkmtmzzdbjymjknzk5otrjntvmnze1zjc5mddlnwexytc.jpeg)
CAS RN: 114214-49-2
tert-Butyl 6-Oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate
Product Availability
Choose a grade to view its available package options.
8 package records8 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260114 | 100g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan | Inquiry |
| Batchno.20250412 | 10g | In stock | Shanghai, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20251113 | 1g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan | Inquiry |
| Batchno.20260508 | 1g / 5g / 25g / 100g | Confirm by inquiry | Shanghai, Shandong | Inquiry |
| Batchno.20251206 | 1kg | In stock | Shanghai | Inquiry |
| Batchno.20250903 | 25g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan | Inquiry |
| Batchno.20260129 | 500g | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20250716 | 5g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
- Product code: SSC-014068
Verified Factory Data
Supply Overview & Packaging Options
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, 5g, 10g, 25g, 100g, 500g, 1000g
- Available purity: >96%, ≥97%
- Inventory rows with stock: 9
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | -- | 5 In Stock | Beijing | Inquiry |
| 1g | >96% | 5 In Stock | Beijing | Inquiry |
| 1g | ≥97% | 5 In Stock | Beijing | Inquiry |
| 5g | -- | 2 In Stock | Beijing | Inquiry |
| 5g | ≥97% | 2 In Stock | Shanghai | Inquiry |
| 5g | >96% | 1 In Stock | Hong Kong | Inquiry |
| 10g | -- | 1 In Stock | Hong Kong | Inquiry |
| 10g | >96% | 1 In Stock | Beijing | Inquiry |
| 10g | ≥97% | 1 In Stock | Shanghai | Inquiry |
| 25g | -- | 0 Out of Stock | Beijing | Inquiry |
| 25g | >96% | 0 Out of Stock | Shenzhen | Inquiry |
| 25g | ≥97% | 0 Out of Stock | Shanghai | Inquiry |
| 100g | -- | 0 Out of Stock | Shanghai | Inquiry |
| 100g | >96% | 0 Out of Stock | Beijing | Inquiry |
| 100g | ≥97% | 0 Out of Stock | Shenzhen | Inquiry |
| 500g | -- | 0 Out of Stock | Shanghai | Inquiry |
| 500g | ≥97% | 0 Out of Stock | Shanghai | Inquiry |
| 1000g | -- | 0 Out of Stock | Beijing | Inquiry |
114214-49-2 / tert-butyl 6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate
tert-butyl 6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate | DTXSID90435605 | tert-Butyl 6-Oxa-3-azabicyclo(3.1.0)hexane-3-carboxylate
Basic Information
CAS
114214-49-2
Multi CAS
Yes
Molecular Formula
C9H15NO3
Molecular Weight
185.220000
Exact Mass
185.105193
SMILES
CC(C)(C)OC(=O)N1CC2C(C1)O2
InChI
InChI=1S/C9H15NO3/c1-9(2,3)13-8(11)10-4-6-7(5-10)12-6/h6-7H,4-5H2,1-3H3
InChIKey
NXZIGGBPLGAPTI-UHFFFAOYSA-N
Synonyms
tert-butyl 6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate
DTXSID90435605
tert-Butyl 6-Oxa-3-azabicyclo(3.1.0)hexane-3-carboxylate
RefChem:383708
DTXCID40386431
Computed Properties
Structural Parameters
Heavy atom count
13
Fraction Csp3
0.89
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
46.47
TPSA
42.07
LogP / Solubility
WLOGP
1
MLOGP
0.88
XLogP3
0.6
Consensus LogP
0.83
Log S (ESOL)
-1.62
Class (ESOL)
Soluble
Log S (Ali)
-1.8
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.7
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)
-3.14
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
2.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (40%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (20%): Harmful in contact with skin [Warning Acute toxicity, dermal]
H315 (80%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (80%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H332 (20%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
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