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CAS 118972-96-6 1-Acetyl-3-hydroxyazetidine molecular structure lightbox
CAS RN: 118972-96-6

1-Acetyl-3-hydroxyazetidine

Product Availability

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8 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260304 1g In stock Inquiry
Batchno.20260603 250mg In stock Inquiry
Batchno.20260524 250mg / 1g / 5g / 25g Confirm by inquiry Shanghai 8-10 business days Inquiry
Batchno.20251228 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251013 1g In stock Shanghai Inquiry
Batchno.20250112 250mg In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250805 25g Out of stock Inquiry
Batchno.20250717 5g In stock Shanghai Inquiry
  • Product code: SSC-019186
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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: 0.25g, 1g, 5g, 10g
  • 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 118972-96-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g >97% 2 In Stock Beijing Inquiry
1g >97% 2 In Stock Hong Kong Inquiry
5g >97% 0 Out of Stock Beijing Inquiry
10g >97% 0 Out of Stock Beijing Inquiry

118972-96-6 / 1-(3-hydroxyazetidin-1-yl)ethanone

1-(3-HYDROXYAZETIDIN-1-YL)ETHAN-1-ONE | RefChem:423887 | 839-374-2

Standard CAS: 118972-96-6 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
118972-96-6
Multi CAS
No
Molecular Formula
C5H9NO2
Molecular Weight
115.130000
Exact Mass
115.063329
SMILES
CC(=O)N1CC(C1)O
InChI
InChI=1S/C5H9NO2/c1-4(7)6-2-5(8)3-6/h5,8H,2-3H2,1H3
InChIKey
CSJAIVZAJZXEAW-UHFFFAOYSA-N
Synonyms
1-(3-HYDROXYAZETIDIN-1-YL)ETHAN-1-ONE RefChem:423887 839-374-2 1-ACETYL-3-HYDROXYAZETIDINE 1-(3-hydroxyazetidin-1-yl)ethanone

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.8
H-bond acceptors
2
H-bond donors
1
Molar refractivity
28.26
TPSA
40.54

LogP / Solubility

WLOGP
-0.79
MLOGP
-0.71
XLogP3
-1.1
Consensus LogP
-0.87
Log S (ESOL)
-0.06
Class (ESOL)
Very soluble
Log S (Ali)
0.07
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.25
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
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)
-3.98

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Corrosive Irritant
Signal
Danger
GHS Hazard Statements
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H335 (50%): 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+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501

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