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CAS 1000152-84-0 2,6-DibroMo-4-(trifluoroMethyl)pyridine molecular structure lightbox
CAS RN: 1000152-84-0

2,6-DibroMo-4-(trifluoroMethyl)pyridine

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260306 100mg In stock Inquiry
Batchno.20250608 1g In stock Inquiry
Batchno.20251228 250mg In stock Inquiry
Batchno.20250508 5g In stock Inquiry
  • Product code: SSC-000056
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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: 0.1g, 0.25g, 1g, 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 1000152-84-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 0 Out of Stock Shanghai Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry
5g ≥95% 0 Out of Stock Beijing Inquiry

1000152-84-0 / 2,6-dibromo-4-(trifluoromethyl)pyridine

2,6-Dibromo-4-(trifluoromethyl)pyridine | 1000152-84-0 | MFCD22682722

Standard CAS: 1000152-84-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1000152-84-0
Multi CAS
No
Molecular Formula
C6H2Br2F3N
Molecular Weight
304.890000
Exact Mass
304.848560
SMILES
C1=C(C=C(N=C1Br)Br)C(F)(F)F
InChI
InChI=1S/C6H2Br2F3N/c7-4-1-3(6(9,10)11)2-5(8)12-4/h1-2H
InChIKey
UYZOWFBHUSJQPJ-UHFFFAOYSA-N
Synonyms
2,6-Dibromo-4-(trifluoromethyl)pyridine 1000152-84-0 MFCD22682722 Pyridine, 2,6-dibromo-4-(trifluoromethyl)- SCHEMBL2480104

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.17
H-bond acceptors
1
Molar refractivity
44.64
TPSA
12.89

LogP / Solubility

WLOGP
3.63
MLOGP
3.2
XLogP3
3.8
Consensus LogP
3.54
Log S (ESOL)
-4.38
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.68
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.65
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.01

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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