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CAS 1186-52-3 Acetic Acid-d4 99.5atom%D molecular structure lightbox
CAS RN: 1186-52-3

Acetic Acid-d4 99.5atom%D

Product Availability

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8 package records8 with current stock4 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250904 0.5ml / 10g / 10ml / 10X0.5ml Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250323 5g In stock Shanghai, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260128 10×0.5ml In stock Inquiry
Batchno.20250312 10g In stock Inquiry
Batchno.20250617 50g In stock Inquiry
Batchno.20250404 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250207 10X0.5ml In stock Shanghai Inquiry
Batchno.20250804 5g In stock Shanghai, Guangdong Inquiry
  • Product code: SSC-018442
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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
  • Available purity: >97%
  • 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 1186-52-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 5 In Stock Beijing Inquiry
5g >97% 5 In Stock Hong Kong Inquiry
10g >97% 2 In Stock Shanghai Inquiry
25g >97% 2 In Stock Hong Kong Inquiry
100g >97% 2 In Stock Beijing Inquiry

1186-52-3 / deuterio 2,2,2-trideuterioacetate

Acetic acid-d4 | (2H3)Acetic (2H)acid | EINECS 214-693-4

Standard CAS: 1186-52-3 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1186-52-3
Multi CAS
Yes
Molecular Formula
C2H4O2
Molecular Weight
64.080000
Exact Mass
64.046236
SMILES
[2H]C([2H])([2H])C(=O)O[2H]
InChI
InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/i1D3/hD
InChIKey
QTBSBXVTEAMEQO-GUEYOVJQSA-N
Synonyms
Acetic acid-d4 (2H3)Acetic (2H)acid EINECS 214-693-4 [2H3]acetic [2H]acid DTXSID60152175

Computed Properties

Structural Parameters

Heavy atom count
4
Fraction Csp3
0.5
H-bond acceptors
1
H-bond donors
1
Molar refractivity
13.31
TPSA
37.3

LogP / Solubility

WLOGP
0.09
MLOGP
0.06
XLogP3
-0.2
Consensus LogP
-0.02
Log S (ESOL)
-0.27
Class (ESOL)
Very soluble
Log S (Ali)
-0.12
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.13
Class (SILICOS-IT)
Very 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)
-3.02

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Flammable Corrosive
Signal
Danger
GHS Hazard Statements
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501

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