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CAS 7787-56-6 BERYLLIUM SULFATE TETRAHYDRATE molecular structure lightbox
CAS RN: 7787-56-6

BERYLLIUM SULFATE TETRAHYDRATE

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  • Product code: starshine_CAS7787-56-6
  • Purity/Analytical Methods: >99.0%
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7787-56-6 / beryllium;sulfate;tetrahydrate

Standard CAS: 7787-56-6 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
7787-56-6
Multi CAS
Yes
Molecular Formula
BeH8O8S
Molecular Weight
177.140000
Exact Mass
177.006171
InChI
InChI=1S/Be.H2O4S.4H2O/c;1-5(2,3)4;;;;/h;(H2,1,2,3,4);4*1H2/q+2;;;;;/p-2
InChIKey
DIMYTQPLZWDZFE-UHFFFAOYSA-L

Physical Properties

Melting Point
518 °F (NTP, 1992)
Boiling Point
1076 °F at 760 mmHg (Decomposes) (NTP, 1992)
Density
1.713 (NTP, 1992) - Denser than water; will sink
Physical Description
Beryllium sulfate tetrahydrate is a white crystalline solid. Sinks in water and dissolves. Odorless. Highly toxic by inhalation and ingestion.
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
10
H-bond acceptors
4
H-bond donors
4
Molar refractivity
30.68
TPSA
206.26

LogP / Solubility

WLOGP
-5.02
MLOGP
-4.42
XLogP3
-5.02
Consensus LogP
-4.82
Log S (ESOL)
2.22
Class (ESOL)
Highly soluble
Log S (Ali)
2.61
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
3.35
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-7.36

Drug-likeness / Medicinal Chemistry

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

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