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CAS 78-43-3 Tris(2,3-dichloropropyl) phosphate molecular structure lightbox
CAS RN: 78-43-3

Tris(2,3-dichloropropyl) phosphate

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2 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260110 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260419 25g / 100g / 500g / 2.5kg / 10kg Confirm by inquiry Shanghai, Chongqing Inquiry
  • Product code: starshine_CAS78-43-3
  • Purity/Analytical Methods: >99.0%
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78-43-3 / tris(2,3-dichloropropyl) phosphate

Standard CAS: 78-43-3 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
78-43-3
Multi CAS
Yes
Molecular Formula
C9H15CL6O4P
Molecular Weight
430.900000
Exact Mass
429.880962
InChI
InChI=1S/C9H15Cl6O4P/c10-1-7(13)4-17-20(16,18-5-8(14)2-11)19-6-9(15)3-12/h7-9H,1-6H2
InChIKey
JZZBTMVTLBHJHL-UHFFFAOYSA-N

Physical Properties

Physical Description
Light yellow liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
20
Fraction Csp3
1
Rotatable bonds
12
H-bond acceptors
4
Molar refractivity
86.55
TPSA
44.76

LogP / Solubility

WLOGP
4.68
MLOGP
4.15
XLogP3
3.3
Consensus LogP
4.04
Log S (ESOL)
-4.67
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.47
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.79
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.02

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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