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CAS 10242-11-2 5-BROMO-1-BENZOFURAN-2-CARBOXYLIC ACID molecular structure lightbox
CAS RN: 10242-11-2

5-BROMO-1-BENZOFURAN-2-CARBOXYLIC ACID

Product Availability

Choose a grade to view its available package options.

7 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251019 1g In stock Inquiry
Batchno.20250806 25g In stock Inquiry
Batchno.20250505 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260401 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250814 250mg In stock Shanghai, Shenzhen, Chengdu Inquiry
Batchno.20250607 25g Out of stock Inquiry
Batchno.20251108 5g In stock Shanghai, Tianjin Inquiry
  • Product code: SSC-003701
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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: ≥95%
  • 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 10242-11-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shanghai Inquiry

10242-11-2 / 5-bromo-1-benzofuran-2-carboxylic acid

5-BROMO-2-BENZOFURANCARBOXYLIC ACID | RefChem:533106 | 5-Bromobenzofuran-2-carboxylic acid

Standard CAS: 10242-11-2 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
10242-11-2
Multi CAS
Yes
Molecular Formula
C9H5BrO3
Molecular Weight
241.040000
Exact Mass
239.942210
SMILES
C1=CC2=C(C=C1Br)C=C(O2)C(=O)O
InChI
InChI=1S/C9H5BrO3/c10-6-1-2-7-5(3-6)4-8(13-7)9(11)12/h1-4H,(H,11,12)
InChIKey
QKUWZCOVKRUXKX-UHFFFAOYSA-N
Synonyms
5-BROMO-2-BENZOFURANCARBOXYLIC ACID RefChem:533106 5-Bromobenzofuran-2-carboxylic acid 5-bromo-1-benzofuran-2-carboxylic acid MFCD00093973

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
50.87
TPSA
50.44

LogP / Solubility

WLOGP
2.89
MLOGP
2.55
XLogP3
3.1
Consensus LogP
2.85
Log S (ESOL)
-3.6
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.63
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.75
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.14

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Acute Toxic Irritant
Signal
Danger
GHS Hazard Statements
H301 (33.3%): Toxic if swallowed [Danger Acute toxicity, oral] H311 (33.3%): Toxic in contact with skin [Danger Acute toxicity, dermal] H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H331 (33.3%): Toxic if inhaled [Danger Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501

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