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CAS 141699-58-3 tert-Butyl 3-[(Methylsulfonyl)oxy]azetidine-1-carboxylate molecular structure lightbox
CAS RN: 141699-58-3

tert-Butyl 3-[(Methylsulfonyl)oxy]azetidine-1-carboxylate

Product Availability

Choose a grade to view its available package options.

8 package records8 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250210 100g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250905 10g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250525 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250417 1kg In stock Shanghai Inquiry
Batchno.20250201 250mg In stock Shanghai, Shenzhen Inquiry
Batchno.20250304 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250223 500g In stock Shanghai Inquiry
Batchno.20250730 5g In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
  • Product code: SSC-052284
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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: 5g, 1g, 10g, 25g, 100g, 500g
  • Available purity: >98%
  • Inventory rows with stock: 5
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 141699-58-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >98% 5 In Stock Shenzhen Inquiry
1g >98% 3 In Stock Shanghai Inquiry
10g >98% 2 In Stock Shenzhen Inquiry
25g >98% 2 In Stock Beijing Inquiry
100g >98% 1 In Stock Shenzhen Inquiry
500g >98% 0 Out of Stock Hong Kong Inquiry

141699-58-3 / tert-butyl 3-methylsulfonyloxyazetidine-1-carboxylate

Standard CAS: 141699-58-3 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
141699-58-3
Multi CAS
No
Molecular Formula
C9H17NO5S
Molecular Weight
251.300000
Exact Mass
251.082744
SMILES
CC(C)(C)OC(=O)N1CC(C1)OS(=O)(=O)C
InChI
InChI=1S/C9H17NO5S/c1-9(2,3)14-8(11)10-5-7(6-10)15-16(4,12)13/h7H,5-6H2,1-4H3
InChIKey
XXBDTKYKFFIAEY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
0.89
Rotatable bonds
2
H-bond acceptors
5
Molar refractivity
57.52
TPSA
72.91

LogP / Solubility

WLOGP
0.58
MLOGP
0.52
XLogP3
0.4
Consensus LogP
0.5
Log S (ESOL)
-1.63
Class (ESOL)
Soluble
Log S (Ali)
-2.04
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.02
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)
-3.84

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Acute Toxic Irritant
Signal
Danger
GHS Hazard Statements
H301 (75%): Toxic if swallowed [Danger Acute toxicity, oral] H315 (25%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (25%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (25%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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