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CAS 13777-25-8 ZIRCONIUM BROMIDE molecular structure lightbox
CAS RN: 13777-25-8

ZIRCONIUM BROMIDE

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250813 500mg / 2g / 10g Confirm by inquiry Shanghai, Guangdong, Hebei Inquiry
  • Product code: starshine_CAS13777-25-8
  • Purity/Analytical Methods: >99.0%
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13777-25-8 / tetrabromozirconium

Standard CAS: 13777-25-8 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
13777-25-8
Multi CAS
No
Molecular Formula
Br4Zr
Molecular Weight
410.840000
Exact Mass
409.573950
SMILES
Br[Zr](Br)(Br)Br
InChI
InChI=1S/4BrH.Zr/h4*1H;/q;;;;+4/p-4
InChIKey
LSWWNKUULMMMIL-UHFFFAOYSA-J

Physical Properties

Physical Description
White powder
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
5
Molar refractivity
35.71
TPSA
0.0000

LogP / Solubility

WLOGP
3.38
MLOGP
3
XLogP3
3.38
Consensus LogP
3.25
Log S (ESOL)
-4.52
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.37
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.14
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)
-2.83

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Corrosive
Signal
Danger
GHS Hazard Statements
H314 (97.7%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement Codes
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501

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