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CAS 24539-60-4 decyl hydrogen phthalate molecular structure lightbox
CAS RN: 24539-60-4

decyl hydrogen phthalate

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20251007 100mg In stock Inquiry
Batchno.20260223 1g In stock Inquiry
Batchno.20250126 250mg In stock Inquiry
  • Product code: SSC-119226
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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: 5g
  • 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 24539-60-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Hong Kong Inquiry

24539-60-4 / 2-decoxycarbonylbenzoic acid

Standard CAS: 24539-60-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
24539-60-4
Multi CAS
Yes
Molecular Formula
C18H26O4
Molecular Weight
306.400000
Exact Mass
306.183109
InChI
InChI=1S/C18H26O4/c1-2-3-4-5-6-7-8-11-14-22-18(21)16-13-10-9-12-15(16)17(19)20/h9-10,12-13H,2-8,11,14H2,1H3,(H,19,20)
InChIKey
FEFCILUKYGHITK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
6
Fraction Csp3
0.56
Rotatable bonds
11
H-bond acceptors
3
H-bond donors
1
Molar refractivity
86.29
TPSA
63.6

LogP / Solubility

WLOGP
4.68
MLOGP
4.13
XLogP3
6.4
Consensus LogP
5.07
Log S (ESOL)
-4.17
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.45
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.86
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.26

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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