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CAS 54962-75-3 3-Amino-5-bromobenzotrifluoride molecular structure lightbox
CAS RN: 54962-75-3

3-Amino-5-bromobenzotrifluoride

Product Availability

Choose a grade to view its available package options.

4 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250531 1g / 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260524 1g In stock Shanghai, Shandong Inquiry
Batchno.20260323 25g Out of stock 5-7 business days Inquiry
Batchno.20250812 5g In stock Shanghai Inquiry
  • Product code: SSC-162800
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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, 1g, 25g, 10g, 100g
  • 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 54962-75-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >97% 4 In Stock Beijing Inquiry
1g >97% 3 In Stock Hong Kong Inquiry
25g >97% 3 In Stock Hong Kong Inquiry
10g >97% 1 In Stock Shanghai Inquiry
100g >97% 0 Out of Stock Shanghai Inquiry

54962-75-3 / 3-bromo-5-(trifluoromethyl)aniline

Standard CAS: 54962-75-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
54962-75-3
Multi CAS
Yes
Molecular Formula
BC7H5NRf3
Molecular Weight
240.020000
Exact Mass
238.955750
InChI
InChI=1S/C7H5BrF3N/c8-5-1-4(7(9,10)11)2-6(12)3-5/h1-3H,12H2
InChIKey
HJTLKVYOWNTDPF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.14
H-bond acceptors
1
H-bond donors
1
Molar refractivity
43.56
TPSA
26.02

LogP / Solubility

WLOGP
3.05
MLOGP
2.69
XLogP3
2.8
Consensus LogP
2.85
Log S (ESOL)
-3.62
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.73
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
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.02

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

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