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CAS 544-19-4 COPPER FORMATE molecular structure lightbox
CAS RN: 544-19-4

COPPER FORMATE

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  • Product code: starshine_CAS544-19-4
  • Purity/Analytical Methods: >99.0%
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544-19-4 / copper diformate

Standard CAS: 544-19-4 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
544-19-4
Multi CAS
Yes
Molecular Formula
C3H2O4U
Molecular Weight
153.580000
Exact Mass
152.924906
InChI
InChI=1S/2CH2O2.Cu/c2*2-1-3;/h2*1H,(H,2,3);/q;;+2/p-2
InChIKey
HFDWIMBEIXDNQS-UHFFFAOYSA-L

Physical Properties

Melting Point
ca 200 °C (decomp)
Density
1.831 at 15 to 68.0 °F (USCG, 1999) - Denser than water; will sink 1.831
Physical Description
Copper formate is a blue crystalline powder. Sinks and mixes with water. (USCG, 1999) Powder-blue, turquoise, or royal blue solid; [Merck Index] Soluble in water
Appearance
Powder-blue, turquoise, or royal blue crystals
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
7
H-bond acceptors
4
Molar refractivity
12.13
TPSA
80.26

LogP / Solubility

WLOGP
-3.27
MLOGP
-2.88
XLogP3
-3.27
Consensus LogP
-3.14
Log S (ESOL)
1.27
Class (ESOL)
Highly soluble
Log S (Ali)
1.54
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
2.06
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)
-5.98

Drug-likeness / Medicinal Chemistry

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

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