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CAS 51655-60-8 3-HEXYLUNDECAN-1-OL molecular structure lightbox
CAS RN: 51655-60-8

3-HEXYLUNDECAN-1-OL

  • Product code: SSC-158595
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 51655-60-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

51655-60-8 / 3-hexylundecan-1-ol

Standard CAS: 51655-60-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
51655-60-8
Multi CAS
Yes
Molecular Formula
C17H36O
Molecular Weight
256.500000
Exact Mass
256.276616
InChI
InChI=1S/C17H36O/c1-3-5-7-9-10-12-14-17(15-16-18)13-11-8-6-4-2/h17-18H,3-16H2,1-2H3
InChIKey
WGDHJACBNBATDD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Fraction Csp3
1
Rotatable bonds
14
H-bond acceptors
1
H-bond donors
1
Molar refractivity
81.94
TPSA
20.23

LogP / Solubility

WLOGP
5.71
MLOGP
5.03
XLogP3
7.7
Consensus LogP
6.15
Log S (ESOL)
-4.1
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.78
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-7.74
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.23

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2

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