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CAS 928758-19-4 4-BroMo-1-chloro-2-(chloroMethyl)benzene molecular structure lightbox
CAS RN: 928758-19-4

4-BroMo-1-chloro-2-(chloroMethyl)benzene

  • Product code: SSC-206754
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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: 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 928758-19-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Beijing Inquiry

928758-19-4 / 4-bromo-1-chloro-2-(chloromethyl)benzene

Standard CAS: 928758-19-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
928758-19-4
Multi CAS
No
Molecular Formula
C7H5BRCL2
Molecular Weight
239.920000
Exact Mass
237.895170
InChI
InChI=1S/C7H5BrCl2/c8-6-1-2-7(10)5(3-6)4-9/h1-3H,4H2
InChIKey
XEFCTCLLJDRHSB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
1
Molar refractivity
48.71
TPSA
0.0000

LogP / Solubility

WLOGP
3.84
MLOGP
3.39
XLogP3
3.6
Consensus LogP
3.61
Log S (ESOL)
-4.13
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.3
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.53
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.46

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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