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CAS 67133-88-4 5-iodo-1-pentanol molecular structure lightbox
CAS RN: 67133-88-4

5-iodo-1-pentanol

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250618 100mg / 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS67133-88-4
  • Purity/Analytical Methods: >99.0%
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67133-88-4 / 5-iodopentan-1-ol

Standard CAS: 67133-88-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
67133-88-4
Multi CAS
No
Molecular Formula
C5H11IO
Molecular Weight
214.040000
Exact Mass
213.985460
InChI
InChI=1S/C5H11IO/c6-4-2-1-3-5-7/h7H,1-5H2
InChIKey
SWYCSFHXRGKNBP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
1
Rotatable bonds
4
H-bond acceptors
1
H-bond donors
1
Molar refractivity
39.82
TPSA
20.23

LogP / Solubility

WLOGP
1.58
MLOGP
1.4
XLogP3
2.2
Consensus LogP
1.73
Log S (ESOL)
-1.9
Class (ESOL)
Soluble
Log S (Ali)
-2.46
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.85
Class (SILICOS-IT)
Moderately 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)
-2.9

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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