CAS RN: 287389-46-2
CALCIUM CARBONATE-13C
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260407 | 250mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS287389-46-2
- Purity/Analytical Methods: >99.0%
287389-46-2 / calcium oxo(113C)methanediolate
Basic Information
CAS
287389-46-2
Multi CAS
Yes
Molecular Formula
CCaO3
Molecular Weight
101.080000
Exact Mass
100.950690
InChI
InChI=1S/CH2O3.Ca/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2/i1+1;
InChIKey
VTYYLEPIZMXCLO-YTBWXGASSA-L
Computed Properties
Structural Parameters
Heavy atom count
5
H-bond acceptors
3
Molar refractivity
11.15
TPSA
63.19
LogP / Solubility
WLOGP
-2.83
MLOGP
-2.5
XLogP3
-2.83
Consensus LogP
-2.72
Log S (ESOL)
1.32
Class (ESOL)
Highly soluble
Log S (Ali)
1.66
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
2.04
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)
-5.34
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1
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