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CAS 66056-40-4 2-[2,4-Bis(benzyloxy)phenyl]acetic Acid molecular structure lightbox
CAS RN: 66056-40-4

2-[2,4-Bis(benzyloxy)phenyl]acetic Acid

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251211 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-175703
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.25g, 0.1g, 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 1
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 66056-40-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 2 In Stock Shenzhen Inquiry
0.1g ≥95% 0 Out of Stock Beijing Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

66056-40-4 / 2-[2,4-bis(phenylmethoxy)phenyl]acetic acid

Standard CAS: 66056-40-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
66056-40-4
Multi CAS
No
Molecular Formula
C22H20O4
Molecular Weight
348.400000
Exact Mass
348.136159
InChI
InChI=1S/C22H20O4/c23-22(24)13-19-11-12-20(25-15-17-7-3-1-4-8-17)14-21(19)26-16-18-9-5-2-6-10-18/h1-12,14H,13,15-16H2,(H,23,24)
InChIKey
MJIBFVVTWAHLOE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
26
Aromatic heavy atom count
18
Fraction Csp3
0.14
Rotatable bonds
8
H-bond acceptors
3
H-bond donors
1
Molar refractivity
99.33
TPSA
55.76

LogP / Solubility

WLOGP
4.47
MLOGP
3.95
XLogP3
3.5
Consensus LogP
3.97
Log S (ESOL)
-4.8
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.65
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.6
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.67

Drug-likeness / Medicinal Chemistry

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

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