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CAS 935-99-9 1-(2-bromo-5-chlorophenyl)ethanone molecular structure lightbox
CAS RN: 935-99-9

1-(2-bromo-5-chlorophenyl)ethanone

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260226 1g / 5g / 10g / 25g Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-207776
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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, 0.25g, 100g
  • 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 935-99-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 5 In Stock Hong Kong Inquiry
5g >97% 5 In Stock Beijing Inquiry
10g >97% 5 In Stock Shenzhen Inquiry
25g >97% 4 In Stock Beijing Inquiry
0.25g >97% 2 In Stock Shanghai Inquiry
100g >97% 0 Out of Stock Hong Kong Inquiry

935-99-9 / 1-(2-bromo-5-chlorophenyl)ethanone

Standard CAS: 935-99-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
935-99-9
Multi CAS
No
Molecular Formula
C8H6BRCLO
Molecular Weight
233.490000
Exact Mass
231.929060
InChI
InChI=1S/C8H6BrClO/c1-5(11)7-4-6(10)2-3-8(7)9/h2-4H,1H3
InChIKey
BCQAWQMDMPBDBW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.12
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
49.16
TPSA
17.07

LogP / Solubility

WLOGP
3.31
MLOGP
2.91
XLogP3
2.9
Consensus LogP
3.04
Log S (ESOL)
-3.71
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.86
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.04
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)
-1.8

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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