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CAS 5614-37-9 Methoxycyclopentane (stabilized with BHT) molecular structure lightbox
CAS RN: 5614-37-9

Methoxycyclopentane (stabilized with BHT)

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260426 100ml In stock Inquiry
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  • Product code: ICTM1698
  • Purity/Analytical Methods: >99.5%(GC)
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5614-37-9 / methoxycyclopentane

Standard CAS: 5614-37-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
5614-37-9
Multi CAS
No
Molecular Formula
C6H12O
Molecular Weight
100.160000
Exact Mass
100.088815
InChI
InChI=1S/C6H12O/c1-7-6-4-2-3-5-6/h6H,2-5H2,1H3
InChIKey
SKTCDJAMAYNROS-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
29.26
TPSA
9.23

LogP / Solubility

WLOGP
1.58
MLOGP
1.37
XLogP3
1.3
Consensus LogP
1.42
Log S (ESOL)
-1.39
Class (ESOL)
Soluble
Log S (Ali)
-1.52
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.74
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)
-2.21

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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