CAS RN: 1700609-17-1
((2R,6R)-6-methylmorpholin-2-yl)methanol
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20250402 |
100mg |
Out of stock |
15 business days | Inquiry |
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Product code:
starshine_CAS1700609-17-1
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Purity/Analytical Methods:
>99.0%
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1700609-17-1 / [(2R,6R)-6-methylmorpholin-2-yl]methanol
Standard CAS: 1700609-17-1
Multi CAS: No
Basic Information
CAS
1700609-17-1
Multi CAS
No
Molecular Formula
C6H13NO2
Molecular Weight
131.170000
Exact Mass
131.094629
SMILES
C[C@@H]1CNC[C@@H](O1)CO
InChI
InChI=1S/C6H13NO2/c1-5-2-7-3-6(4-8)9-5/h5-8H,2-4H2,1H3/t5-,6-/m1/s1
InChIKey
RLUNMFUEXOEXSZ-PHDIDXHHSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
34.29
TPSA
41.49
LogP / Solubility
WLOGP
-0.64
MLOGP
-0.58
XLogP3
-0.8
Consensus LogP
-0.67
Log S (ESOL)
-0.18
Class (ESOL)
Very soluble
Log S (Ali)
-0.17
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.1
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
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)
-3.98
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5