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CAS 13831-31-7 Acetoxyacetyl Chloride molecular structure lightbox
CAS RN: 13831-31-7

Acetoxyacetyl Chloride

Product Availability

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9 package records9 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260412 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251212 100g In stock Inquiry
Batchno.20250127 25g In stock Inquiry
Batchno.20251124 500g In stock Inquiry
Batchno.20250114 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250926 100g In stock Shanghai, Shandong, Hebei Inquiry
Batchno.20250423 2.5kg In stock Shanghai Inquiry
Batchno.20250315 25g In stock Shanghai, Shandong, Guangdong Inquiry
Batchno.20250404 500g In stock Shanghai, Chongqing Inquiry
  • Product code: SSC-048224
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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, 100g, 500g
  • Available purity: >97%
  • Inventory rows with stock: 6
  • 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 13831-31-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 5 In Stock Shenzhen Inquiry
5g >97% 5 In Stock Shanghai Inquiry
10g >97% 5 In Stock Shanghai Inquiry
25g >97% 5 In Stock Hong Kong Inquiry
100g >97% 5 In Stock Shanghai Inquiry
500g >97% 5 In Stock Beijing Inquiry

13831-31-7 / (2-chloro-2-oxoethyl) acetate

Standard CAS: 13831-31-7 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
13831-31-7
Multi CAS
No
Molecular Formula
C4H5ClO3
Molecular Weight
136.530000
Exact Mass
135.992722
SMILES
CC(=O)OCC(=O)Cl
InChI
InChI=1S/C4H5ClO3/c1-3(6)8-2-4(5)7/h2H2,1H3
InChIKey
HZDNNJABYXNPPV-UHFFFAOYSA-N

Physical Properties

Physical Description
Corrosive liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
27.49
TPSA
43.37

LogP / Solubility

WLOGP
0.31
MLOGP
0.27
XLogP3
0.7
Consensus LogP
0.43
Log S (ESOL)
-0.75
Class (ESOL)
Very soluble
Log S (Ali)
-0.91
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.05
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)
-3.33

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
1.5

Safety & Transport

Pictogram(s)
Corrosive Irritant
Signal
Danger
GHS Hazard Statements
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H335 (86.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, and P501

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