CAS RN: 696582-88-4

(R)-3-(Methoxymethyl)morpholine HCl

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Batchno.20250129 100mg / 250mg / 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS696582-88-4
  • Purity/Analytical Methods: >99.0%
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696582-88-4 / (3R)-3-(methoxymethyl)morpholine

Standard CAS: 696582-88-4 Multi CAS: Yes

Basic Information

CAS
696582-88-4
Multi CAS
Yes
Molecular Formula
C6H13NO2
Molecular Weight
131.170000
Exact Mass
131.094629
InChI
InChI=1S/C6H13NO2/c1-8-4-6-5-9-3-2-7-6/h6-7H,2-5H2,1H3/t6-/m1/s1
InChIKey
JSKYPBXAHHTFRT-ZCFIWIBFSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
34.49
TPSA
30.49

LogP / Solubility

WLOGP
-0.38
MLOGP
-0.34
XLogP3
-0.7
Consensus LogP
-0.47
Log S (ESOL)
-0.28
Class (ESOL)
Very soluble
Log S (Ali)
-0.36
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.44
Class (SILICOS-IT)
Very 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)
-3.79

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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