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CAS 758-12-3 Acetic Acid-d1 98atom%D molecular structure lightbox
CAS RN: 758-12-3

Acetic Acid-d1 98atom%D

Product Availability

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8 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250926 100g Out of stock Inquiry
Batchno.20260321 10g In stock Inquiry
Batchno.20251221 1g In stock Inquiry
Batchno.20251114 250g Out of stock Inquiry
Batchno.20251014 25g Out of stock Inquiry
Batchno.20250805 50g In stock Inquiry
Batchno.20250823 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260207 10g / 50g / 250g Confirm by inquiry Shanghai, Guangdong Inquiry
  • Product code: SSC-185234
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g, 10g, 25g, 100g
  • Available purity: N/A
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 758-12-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g N/A 0 Out of Stock Shanghai Inquiry
10g N/A 0 Out of Stock Shanghai Inquiry
25g N/A 0 Out of Stock Beijing Inquiry
100g N/A 0 Out of Stock Beijing Inquiry

758-12-3 / deuterio acetate

Standard CAS: 758-12-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
758-12-3
Multi CAS
Yes
Molecular Formula
C2H4O2
Molecular Weight
61.060000
Exact Mass
61.027406
InChI
InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/i/hD
InChIKey
QTBSBXVTEAMEQO-DYCDLGHISA-N

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

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