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CAS 2040-88-2 2-bromo-6-chloro-phenol molecular structure lightbox
CAS RN: 2040-88-2

2-bromo-6-chloro-phenol

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250308 1g / 5g / 25g / 100g Out of stock 8-10 business days Inquiry
  • Product code: SSC-095997
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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, 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 2040-88-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 5 In Stock Shanghai Inquiry
5g ≥97% 5 In Stock Beijing Inquiry
25g ≥97% 2 In Stock Shanghai Inquiry
10g ≥97% 1 In Stock Shanghai Inquiry
100g ≥97% 0 Out of Stock Shanghai Inquiry

2040-88-2 / 2-bromo-6-chlorophenol

Standard CAS: 2040-88-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2040-88-2
Multi CAS
No
Molecular Formula
C6H4BrClO
Molecular Weight
207.450000
Exact Mass
205.913410
SMILES
C1=CC(=C(C(=C1)Br)O)Cl
InChI
InChI=1S/C6H4BrClO/c7-4-2-1-3-5(8)6(4)9/h1-3,9H
InChIKey
LUECOFFMVWPWDR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
H-bond acceptors
1
H-bond donors
1
Molar refractivity
40.82
TPSA
20.23

LogP / Solubility

WLOGP
2.81
MLOGP
2.47
XLogP3
3.3
Consensus LogP
2.86
Log S (ESOL)
-3.39
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.29
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.34
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)
-1.99

Drug-likeness / Medicinal Chemistry

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

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