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CAS 43153-20-4 5,5-BIS(BROMOMETHYL)-2,2-DIMETHYL-1,3-DIOXANE molecular structure lightbox
CAS RN: 43153-20-4

5,5-BIS(BROMOMETHYL)-2,2-DIMETHYL-1,3-DIOXANE

Product Availability

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6 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250317 100g In stock Shanghai Inquiry
Batchno.20251125 1g In stock Shanghai, Shenzhen, Wuhan Inquiry
Batchno.20250511 250mg In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250425 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
Batchno.20260202 25g In stock Shanghai, Wuhan Inquiry
Batchno.20250306 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: starshine_CAS43153-20-4
  • Purity/Analytical Methods: >99.0%
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43153-20-4 / 5,5-bis(bromomethyl)-2,2-dimethyl-1,3-dioxane

Standard CAS: 43153-20-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
43153-20-4
Multi CAS
No
Molecular Formula
C8H14BR2O2
Molecular Weight
302.000000
Exact Mass
301.934010
InChI
InChI=1S/C8H14Br2O2/c1-7(2)11-5-8(3-9,4-10)6-12-7/h3-6H2,1-2H3
InChIKey
CEWDAROJZGKUGQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
56
TPSA
18.46

LogP / Solubility

WLOGP
2.55
MLOGP
2.25
XLogP3
2.1
Consensus LogP
2.3
Log S (ESOL)
-3.18
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.87
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.98
Class (SILICOS-IT)
Poorly 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
No
Log Kp (skin permeation)
-2.75

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

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