![CAS 1181816-12-5 tert-butyl 6-oxo-2-azaspiro[3.3]heptane-2-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1181816-12-5.gif)
CAS RN: 1181816-12-5
tert-butyl 6-oxo-2-azaspiro[3.3]heptane-2-carboxylate
Product Availability
Choose a grade to view its available package options.
9 package records9 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250220 | 100g | In stock | Shanghai | Inquiry |
| Batchno.20250527 | 100mg | In stock | Shanghai, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20260310 | 10g | In stock | Shanghai, Shenzhen, Tianjin, Chengdu | Inquiry |
| Batchno.20251019 | 1g | In stock | Shanghai, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20260521 | 1kg | In stock | Shanghai | Inquiry |
| Batchno.20251015 | 250mg | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20250320 | 25g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan | Inquiry |
| Batchno.20260120 | 500g | In stock | Shanghai | Inquiry |
| Batchno.20250222 | 5g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
- Product code: SSC-018019
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, 0.25g, 5g, 10g, 25g, 100g, 500g
- Available purity: >97%
- Inventory rows with stock: 2
- 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 | >97% | 5 In Stock | Beijing | Inquiry |
| 0.25g | >97% | 3 In Stock | Shanghai | Inquiry |
| 5g | >97% | 0 Out of Stock | Hong Kong | Inquiry |
| 10g | >97% | 0 Out of Stock | Shanghai | Inquiry |
| 25g | >97% | 0 Out of Stock | Hong Kong | Inquiry |
| 100g | >97% | 0 Out of Stock | Shanghai | Inquiry |
| 500g | >97% | 0 Out of Stock | Beijing | Inquiry |
1181816-12-5 / tert-butyl 6-oxo-2-azaspiro[3.3]heptane-2-carboxylate
TERT-BUTYL 6-OXO-2-AZASPIRO[3.3]HEPTANE-2-CARBOXYLATE | DTXSID30680475 | tert-butyl 6-oxo-2-azaspiro(3.3)heptane-2-carboxylate
Basic Information
CAS
1181816-12-5
Multi CAS
Yes
Molecular Formula
C11H17NO3
Molecular Weight
211.260000
Exact Mass
211.120843
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CC(=O)C2
InChI
InChI=1S/C11H17NO3/c1-10(2,3)15-9(14)12-6-11(7-12)4-8(13)5-11/h4-7H2,1-3H3
InChIKey
HQHRAGXKFOTSQE-UHFFFAOYSA-N
Synonyms
TERT-BUTYL 6-OXO-2-AZASPIRO[3.3]HEPTANE-2-CARBOXYLATE
DTXSID30680475
tert-butyl 6-oxo-2-azaspiro(3.3)heptane-2-carboxylate
RefChem:188194
DTXCID70631224
Computed Properties
Structural Parameters
Heavy atom count
15
Fraction Csp3
0.82
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
54.48
TPSA
46.61
LogP / Solubility
WLOGP
1.59
MLOGP
1.4
XLogP3
0.5
Consensus LogP
1.16
Log S (ESOL)
-2.15
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.44
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.35
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)
-2.88
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (80%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (60%): Harmful in contact with skin [Warning Acute toxicity, dermal]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H332 (60%): 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
Customers Also Viewed
-
ethyl 3-(benzyloxy)-1-cyanocyclobutane-1-carboxylate
- CAS RN: 1181816-13-6
- Product Code: SSC-018020
-
N-[(11bR)-8,9,10,11,12,13,14,15-octahydro-4-oxido-2,6-di-9-phenanthrenyldinaphtho[2,1-d:1′,2′-f][1,3,2]dioxaphosphepin-4-yl]-1,1,1-trifluoro-Methanesulfonamide
- CAS RN: 1181834-74-1
- Product Code: starshine_CAS1181834-74-1
- Purity/Analytical method: >99.0%
-
-
RU-302
- CAS RN: 1182129-77-6
- Product Code: starshine_CAS1182129-77-6
- Purity/Analytical method: >99.0%
-
(5-Fluoro-2-hydroxyphenyl)(piperidin-4-yl)methanone hydrochloride
- CAS RN: 1182284-28-1
- Product Code: SSC-018036
-
Methyl 4-(4′-chloro-4-biphenylylsulfonylaMino)benzoate
- CAS RN: 1182284-29-2
- Product Code: starshine_CAS1182284-29-2
- Purity/Analytical method: >99.0%
![CAS 1181834-74-1 N-[(11bR)-8,9,10,11,12,13,14,15-octahydro-4-oxido-2,6-di-9-phenanthrenyldinaphtho[2,1-d:1′,2′-f][1,3,2]dioxaphosphepin-4-yl]-1,1,1-trifluoro-Methanesulfonamide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1181834-74-1.gif)
![CAS 1181864-34-5 1H-PYRROLO[2,3-B]PYRIDIN-3-YL ACETATE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1181864-34-5.gif)
