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CAS 43217-28-3 2-CHLORO-9,10-DIPHENYLANTHRACENE molecular structure lightbox
CAS RN: 43217-28-3

2-CHLORO-9,10-DIPHENYLANTHRACENE

  • Product code: SSC-151531
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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: ＞97%
  • 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 43217-28-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

43217-28-3 / 2-chloro-9,10-diphenylanthracene

Standard CAS: 43217-28-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
43217-28-3
Multi CAS
No
Molecular Formula
C26H17CL
Molecular Weight
364.900000
Exact Mass
364.101878
InChI
InChI=1S/C26H17Cl/c27-20-15-16-23-24(17-20)26(19-11-5-2-6-12-19)22-14-8-7-13-21(22)25(23)18-9-3-1-4-10-18/h1-17H
InChIKey
PLMFIWDPKYXMGE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
26
Rotatable bonds
2
Molar refractivity
117.34
TPSA
0.0000

LogP / Solubility

WLOGP
7.98
MLOGP
7.04
XLogP3
8.3
Consensus LogP
7.77
Log S (ESOL)
-7.71
Class (ESOL)
Insoluble
Log S (Ali)
-8.31
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.9
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.72

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5

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