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CAS 10016-52-1 2,8-Dibromodibenzofuran molecular structure lightbox
CAS RN: 10016-52-1

2,8-Dibromodibenzofuran

Product Availability

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2 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251201 250mg / 1g / 5g / 25g / 100g Confirm by inquiry Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250319 5g In stock Shanghai Inquiry
  • Product code: SSC-000561
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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
  • 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 10016-52-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Beijing Inquiry

10016-52-1 / 2,8-dibromodibenzofuran

2,8-Dibromodibenzofuran | 2,8-Dibromodibenzo[b,d]furan | Dibenzofuran, 2,8-dibromo-

Standard CAS: 10016-52-1 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
10016-52-1
Multi CAS
Yes
Molecular Formula
C12H6Br2O
Molecular Weight
325.980000
Exact Mass
325.876490
SMILES
C1=CC2=C(C=C1Br)C3=C(O2)C=CC(=C3)Br
InChI
InChI=1S/C12H6Br2O/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1-6H
InChIKey
UFCZRCPQBWIXTR-UHFFFAOYSA-N
Synonyms
2,8-Dibromodibenzofuran 2,8-Dibromodibenzo[b,d]furan Dibenzofuran, 2,8-dibromo- DTXSID40142993 2,8-Dibromodibenzo(b,d)furan

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
13
H-bond acceptors
1
Molar refractivity
69.12
TPSA
13.14

LogP / Solubility

WLOGP
5.11
MLOGP
4.51
XLogP3
5.8
Consensus LogP
5.14
Log S (ESOL)
-5.72
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.92
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.02
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.08

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Acute Toxic Irritant
Signal
Danger
GHS Hazard Statements
H301 (97.5%): Toxic if swallowed [Danger Acute toxicity, oral] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P264, P264+P265, P270, P273, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, and P501

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