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CAS 925-93-9 Ethanol-d1 99atom%D molecular structure lightbox
CAS RN: 925-93-9

Ethanol-d1 99atom%D

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260217 5ml / 5g / 25ml / 25g / 50g / 250g Confirm by inquiry Shanghai, Guangdong, Hebei, Shandong 8-10 business days Inquiry
  • Product code: ICTE0221
  • Purity/Analytical Methods: >99.0%(GC)
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925-93-9 / deuteriooxyethane

Standard CAS: 925-93-9 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
925-93-9
Multi CAS
Yes
Molecular Formula
C2H6O
Molecular Weight
47.070000
Exact Mass
47.048142
InChI
InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3/i3D
InChIKey
LFQSCWFLJHTTHZ-WFVSFCRTSA-N

Physical Properties

Physical Description
Clear colorless liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
3
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
12.76
TPSA
20.23

LogP / Solubility

MLOGP
-0.02
XLogP3
-0.1
Consensus LogP
-0.04
Log S (ESOL)
-0.12
Class (ESOL)
Very soluble
Log S (Ali)
0.06
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.04
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3

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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