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CAS 5182-67-2 1,2-DIIODO-4,5-DIMETHYLBENZENE molecular structure lightbox
CAS RN: 5182-67-2

1,2-DIIODO-4,5-DIMETHYLBENZENE

  • Product code: SSC-158846
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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: 1g
  • 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 5182-67-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

5182-67-2 / 1,2-diiodo-4,5-dimethylbenzene

Standard CAS: 5182-67-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
5182-67-2
Multi CAS
No
Molecular Formula
C8H8I2
Molecular Weight
357.960000
Exact Mass
357.871550
InChI
InChI=1S/C8H8I2/c1-5-3-7(9)8(10)4-6(5)2/h3-4H,1-2H3
InChIKey
LXOHTTLTWLSPNR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.25
Molar refractivity
61.35
TPSA
0.0000

LogP / Solubility

WLOGP
3.51
MLOGP
3.11
XLogP3
4
Consensus LogP
3.54
Log S (ESOL)
-4.72
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.03
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.9
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.41

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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