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CAS 175205-82-0 2-Bromo-3-(trifluoromethyl)pyridine molecular structure lightbox
CAS RN: 175205-82-0

2-Bromo-3-(trifluoromethyl)pyridine

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250308 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-076870
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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, 100g, 10g, 25g, 500g
  • Available purity: ≥98%
  • Inventory rows with stock: 3
  • 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 175205-82-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥98% 4 In Stock Shenzhen Inquiry
5g ≥98% 2 In Stock Hong Kong Inquiry
100g ≥98% 1 In Stock Beijing Inquiry
10g ≥98% 0 Out of Stock Hong Kong Inquiry
25g ≥98% 0 Out of Stock Hong Kong Inquiry
500g ≥98% 0 Out of Stock Hong Kong Inquiry

175205-82-0 / 2-bromo-3-(trifluoromethyl)pyridine

Standard CAS: 175205-82-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
175205-82-0
Multi CAS
No
Molecular Formula
C6H3BrF3N
Molecular Weight
225.990000
Exact Mass
224.940100
SMILES
C1=CC(=C(N=C1)Br)C(F)(F)F
InChI
InChI=1S/C6H3BrF3N/c7-5-4(6(8,9)10)2-1-3-11-5/h1-3H
InChIKey
OFGSIPQYQUVVPL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.17
H-bond acceptors
1
Molar refractivity
36.94
TPSA
12.89

LogP / Solubility

WLOGP
2.86
MLOGP
2.52
XLogP3
2.8
Consensus LogP
2.73
Log S (ESOL)
-3.45
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.48
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.51
Class (SILICOS-IT)
Poorly 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)
-2.07

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Flammable Corrosive Acute Toxic Irritant
Signal
Danger
GHS Hazard Statements
H228 (89.1%): Flammable solid [Danger Flammable solids] H300 (89.1%): Fatal if swallowed [Danger Acute toxicity, oral] H315 (97.8%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (87%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H319 (10.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P210, P240, P241, P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P405, and P501

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