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CAS 7398-82-5 alpha,alpha,alpha’,alpha’-Tetrachloro-p-xylene molecular structure lightbox
CAS RN: 7398-82-5

alpha,alpha,alpha’,alpha’-Tetrachloro-p-xylene

  • Product code: SSC-183403
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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 7398-82-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Beijing Inquiry

7398-82-5 / 1,4-bis(dichloromethyl)benzene

Standard CAS: 7398-82-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
7398-82-5
Multi CAS
Yes
Molecular Formula
C8H6CL4
Molecular Weight
243.900000
Exact Mass
243.919411
InChI
InChI=1S/C8H6Cl4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4,7-8H
InChIKey
VOWDXSFJQOEFSH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
2
Molar refractivity
55.34
TPSA
0.0000

LogP / Solubility

WLOGP
4.64
MLOGP
4.09
XLogP3
4.1
Consensus LogP
4.28
Log S (ESOL)
-4.51
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.91
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.34
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)
-0.91

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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