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CAS 1653-33-4 4-TETRADECANOL molecular structure lightbox
CAS RN: 1653-33-4

4-TETRADECANOL

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260121 50mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1653-33-4
  • Purity/Analytical Methods: >99.0%
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1653-33-4 / tetradecan-4-ol

Standard CAS: 1653-33-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1653-33-4
Multi CAS
No
Molecular Formula
C14H30O
Molecular Weight
214.390000
Exact Mass
214.229666
SMILES
CCCCCCCCCCC(CCC)O
InChI
InChI=1S/C14H30O/c1-3-5-6-7-8-9-10-11-13-14(15)12-4-2/h14-15H,3-13H2,1-2H3
InChIKey
HRDGAIGDKJXHIU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
1
Rotatable bonds
11
H-bond acceptors
1
H-bond donors
1
Molar refractivity
68.14
TPSA
20.23

LogP / Solubility

WLOGP
4.68
MLOGP
4.12
XLogP3
6
Consensus LogP
4.93
Log S (ESOL)
-3.39
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.7
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.26
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
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)
-0.71

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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