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CAS 7325-16-8 GLYCEROL-(OD)3 molecular structure lightbox
CAS RN: 7325-16-8

GLYCEROL-(OD)3

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2 package records1 with current stock2 grade groups
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Batchno.20260626 1g In stock Inquiry
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  • Product code: starshine_CAS7325-16-8
  • Purity/Analytical Methods: >99.0%
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7325-16-8 / 1,2,3-trideuteriooxypropane

Standard CAS: 7325-16-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
7325-16-8
Multi CAS
No
Molecular Formula
C3H8O3
Molecular Weight
95.110000
Exact Mass
95.066174
InChI
InChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2/i4D,5D,6D
InChIKey
PEDCQBHIVMGVHV-WVALGTIDSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
3
Molar refractivity
20.18
TPSA
60.69

LogP / Solubility

WLOGP
-1.67
MLOGP
-1.48
XLogP3
-1.8
Consensus LogP
-1.65
Log S (ESOL)
0.77
Class (ESOL)
Highly soluble
Log S (Ali)
0.89
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.89
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)
-4.47

Drug-likeness / Medicinal Chemistry

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

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