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CAS 350699-92-2 2-Bromo-3,4-Difluoronitrobenzene molecular structure lightbox
CAS RN: 350699-92-2

2-Bromo-3,4-Difluoronitrobenzene

  • Product code: SSC-141775
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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, 10g, 25g, 100g
  • 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 350699-92-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥98% 3 In Stock Hong Kong Inquiry
5g ≥98% 3 In Stock Shenzhen Inquiry
10g ≥98% 2 In Stock Shenzhen Inquiry
25g ≥98% 0 Out of Stock Shenzhen Inquiry
100g ≥98% 0 Out of Stock Hong Kong Inquiry

350699-92-2 / 3-bromo-1,2-difluoro-4-nitrobenzene

Standard CAS: 350699-92-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
350699-92-2
Multi CAS
Yes
Molecular Formula
BC6H2NO2Rf2
Molecular Weight
237.990000
Exact Mass
236.923700
InChI
InChI=1S/C6H2BrF2NO2/c7-5-4(10(11)12)2-1-3(8)6(5)9/h1-2H
InChIKey
OANBJAYTIQWYDQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
40.71
TPSA
43.14

LogP / Solubility

WLOGP
2.64
MLOGP
2.32
XLogP3
2.6
Consensus LogP
2.52
Log S (ESOL)
-3.28
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.41
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)
-2.3

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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