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CAS 176-92-1 1-Oxa-8-azaspiro[4.5]decane molecular structure lightbox
CAS RN: 176-92-1

1-Oxa-8-azaspiro[4.5]decane

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250810 1g Out of stock 30 business days Inquiry
  • Product code: starshine_CAS176-92-1
  • Purity/Analytical Methods: >99.0%
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176-92-1 / 1-oxa-8-azaspiro[4.5]decane

Standard CAS: 176-92-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
176-92-1
Multi CAS
No
Molecular Formula
C8H15NO
Molecular Weight
141.210000
Exact Mass
141.115364
SMILES
C1CC2(CCNCC2)OC1
InChI
InChI=1S/C8H15NO/c1-2-8(10-7-1)3-5-9-6-4-8/h9H,1-7H2
InChIKey
KVYOWXUQJLOCIA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
40.02
TPSA
21.26

LogP / Solubility

WLOGP
0.92
MLOGP
0.8
XLogP3
0.5
Consensus LogP
0.74
Log S (ESOL)
-1.29
Class (ESOL)
Soluble
Log S (Ali)
-1.38
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.34
Class (SILICOS-IT)
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)
-2.93

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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