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CAS 130723-13-6 3-Bromo-5-fluorobenzotrifluoride molecular structure lightbox
CAS RN: 130723-13-6

3-Bromo-5-fluorobenzotrifluoride

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250501 100g In stock Inquiry
Batchno.20250107 1g In stock Inquiry
Batchno.20260515 25g In stock Inquiry
Batchno.20251007 500g In stock Inquiry
Batchno.20250330 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250816 1g / 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260501 1g In stock Shanghai Inquiry
  • Product code: SSC-037296
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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: 5g, 10g, 25g, 100g, 500g
  • Available purity: >97%
  • Inventory rows with stock: 5
  • 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 130723-13-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >97% 5 In Stock Shanghai Inquiry
10g >97% 5 In Stock Hong Kong Inquiry
25g >97% 5 In Stock Shanghai Inquiry
100g >97% 5 In Stock Shanghai Inquiry
500g >97% 2 In Stock Beijing Inquiry

130723-13-6 / 1-bromo-3-fluoro-5-(trifluoromethyl)benzene

Standard CAS: 130723-13-6 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
130723-13-6
Multi CAS
No
Molecular Formula
C7H3BrF4
Molecular Weight
243.000000
Exact Mass
241.935430
SMILES
C1=C(C=C(C=C1F)Br)C(F)(F)F
InChI
InChI=1S/C7H3BrF4/c8-5-1-4(7(10,11)12)2-6(9)3-5/h1-3H
InChIKey
LIGBGEJPUQBLTG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.14
H-bond acceptors
4
Molar refractivity
39.1
TPSA
0.0000

LogP / Solubility

WLOGP
3.61
MLOGP
3.18
XLogP3
3.6
Consensus LogP
3.46
Log S (ESOL)
-3.99
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.16
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.23
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)
-1.64

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)
Flammable Irritant
Signal
Warning
GHS Hazard Statements
H226 (11.1%): Flammable liquid and vapor [Warning Flammable liquids] H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501

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