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CAS 76-04-0 Chlorodifluoroacetic Acid molecular structure lightbox
CAS RN: 76-04-0

Chlorodifluoroacetic Acid

Product Availability

Choose a grade to view its available package options.

5 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250611 100g Out of stock Inquiry
Batchno.20250306 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260404 500g Out of stock Inquiry
Batchno.20250821 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250825 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Hebei, Shandong Inquiry
  • Product code: SSC-185421
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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: 100g
  • Available purity: >97%
  • 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 76-04-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g >97% 0 Out of Stock Shenzhen Inquiry

76-04-0 / 2-chloro-2,2-difluoroacetic acid

Standard CAS: 76-04-0 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
76-04-0
Multi CAS
Yes
Molecular Formula
C2HCLF2O2
Molecular Weight
130.480000
Exact Mass
129.963313
InChI
InChI=1S/C2HClF2O2/c3-2(4,5)1(6)7/h(H,6,7)
InChIKey
OAWAZQITIZDJRB-UHFFFAOYSA-N

Physical Properties

Physical Description
Clear colorless to light brown liquid; mp = 20 deg C
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
18.44
TPSA
37.3

LogP / Solubility

WLOGP
0.9
MLOGP
0.79
XLogP3
1.2
Consensus LogP
0.96
Log S (ESOL)
-1.15
Class (ESOL)
Soluble
Log S (Ali)
-1.28
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.38
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)
-2.88

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

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