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CAS 32602-69-0 3-HYDROXYTRIDECANOIC ACID molecular structure lightbox
CAS RN: 32602-69-0

3-HYDROXYTRIDECANOIC ACID

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6 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251101 100mg In stock Inquiry
Batchno.20251118 250mg Out of stock Inquiry
Batchno.20260628 25mg In stock Inquiry
Batchno.20260310 50mg In stock Inquiry
Batchno.20251002 5mg Out of stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251231 50mg / 100mg / 250mg Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS32602-69-0
  • Purity/Analytical Methods: >99.0%
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32602-69-0 / 3-hydroxytridecanoic acid

Standard CAS: 32602-69-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
32602-69-0
Multi CAS
No
Molecular Formula
C13H26O3
Molecular Weight
230.340000
Exact Mass
230.188195
InChI
InChI=1S/C13H26O3/c1-2-3-4-5-6-7-8-9-10-12(14)11-13(15)16/h12,14H,2-11H2,1H3,(H,15,16)
InChIKey
CWSNHZHHWHLJIM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
0.92
Rotatable bonds
11
H-bond acceptors
2
H-bond donors
2
Molar refractivity
65.49
TPSA
57.53

LogP / Solubility

WLOGP
3.35
MLOGP
2.95
XLogP3
4.1
Consensus LogP
3.47
Log S (ESOL)
-2.65
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.87
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-5.26
Class (SILICOS-IT)
Slightly 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)
-1.74

Drug-likeness / Medicinal Chemistry

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

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