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CAS 174508-31-7 2,5-Dibromo-3,4-ethylenedioxythiophene molecular structure lightbox
CAS RN: 174508-31-7

2,5-Dibromo-3,4-ethylenedioxythiophene

Product Availability

Choose a grade to view its available package options.

5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260410 1g In stock Shanghai, Shenzhen, Wuhan Inquiry
Batchno.20250723 250mg In stock Shanghai, Tianjin Inquiry
Batchno.20250817 25g Out of stock Inquiry
Batchno.20251112 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250813 1g / 5g / 25g / 100g Confirm by inquiry Shandong, Shanghai, Guangdong Inquiry
  • Product code: SSC-076551
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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, 25g, 10g
  • Available purity: ≥97%
  • Inventory rows with stock: 4
  • 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 174508-31-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 5 In Stock Shenzhen Inquiry
5g ≥97% 5 In Stock Hong Kong Inquiry
25g ≥97% 5 In Stock Shanghai Inquiry
10g ≥97% 2 In Stock Shanghai Inquiry

174508-31-7 / 5,7-dibromo-2,3-dihydrothieno[3,4-b][1,4]dioxine

Standard CAS: 174508-31-7 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
174508-31-7
Multi CAS
No
Molecular Formula
C6H4Br2O2S
Molecular Weight
299.970000
Exact Mass
299.827830
SMILES
C1COC2=C(SC(=C2O1)Br)Br
InChI
InChI=1S/C6H4Br2O2S/c7-5-3-4(6(8)11-5)10-2-1-9-3/h1-2H2
InChIKey
FHMRWRBNAIDRAP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
5
Fraction Csp3
0.33
H-bond acceptors
3
Molar refractivity
50.71
TPSA
18.46

LogP / Solubility

WLOGP
3.04
MLOGP
2.69
XLogP3
3.4
Consensus LogP
3.04
Log S (ESOL)
-3.95
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.22
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.14
Class (SILICOS-IT)
Slightly 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)
-2.39

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501

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