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CAS 254454-54-1 1-(tert-Butoxycarbonyl)-3-iodoazetidine molecular structure lightbox
CAS RN: 254454-54-1

1-(tert-Butoxycarbonyl)-3-iodoazetidine

Product Availability

Choose a grade to view its available package options.

6 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250304 100g In stock Shanghai, Wuhan, Chengdu Inquiry
Batchno.20250906 10g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251011 1g In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20251121 1kg In stock Shanghai, Chengdu Inquiry
Batchno.20250510 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250331 500g In stock Shanghai, Chengdu Inquiry
  • Product code: SSC-121393
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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: 1g, 5g, 10g, 25g, 50g, 100g, 500g, 1000g
  • Available purity: >97%
  • Inventory rows with stock: 2
  • 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 254454-54-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g -- 3 In Stock Shanghai Inquiry
1g >97% 3 In Stock Shenzhen Inquiry
5g -- 0 Out of Stock Shanghai Inquiry
5g >97% 0 Out of Stock Shanghai Inquiry
10g -- 0 Out of Stock Beijing Inquiry
10g >97% 0 Out of Stock Hong Kong Inquiry
25g -- 0 Out of Stock Hong Kong Inquiry
25g >97% 0 Out of Stock Shanghai Inquiry
50g -- 0 Out of Stock Shanghai Inquiry
50g >97% 0 Out of Stock Beijing Inquiry
100g -- 0 Out of Stock Hong Kong Inquiry
100g >97% 0 Out of Stock Shenzhen Inquiry
500g -- 0 Out of Stock Hong Kong Inquiry
500g >97% 0 Out of Stock Hong Kong Inquiry
1000g -- 0 Out of Stock Shenzhen Inquiry
1000g >97% 0 Out of Stock Hong Kong Inquiry

254454-54-1 / tert-butyl 3-iodoazetidine-1-carboxylate

Standard CAS: 254454-54-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
254454-54-1
Multi CAS
No
Molecular Formula
C8H14INO2
Molecular Weight
283.110000
Exact Mass
283.006930
SMILES
CC(C)(C)OC(=O)N1CC(C1)I
InChI
InChI=1S/C8H14INO2/c1-8(2,3)12-7(11)10-4-6(9)5-10/h6H,4-5H2,1-3H3
InChIKey
XPDIKRMPZNLBAC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.88
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
55.62
TPSA
29.54

LogP / Solubility

WLOGP
2.04
MLOGP
1.81
XLogP3
1.9
Consensus LogP
1.92
Log S (ESOL)
-2.88
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.35
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.19
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3

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

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