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CAS 67127-91-7 2,5-BIS-BENZYLOXY-BENZOIC ACID molecular structure lightbox
CAS RN: 67127-91-7

2,5-BIS-BENZYLOXY-BENZOIC ACID

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250620 250mg / 1g / 5g / 25g Out of stock 8-10 business days Inquiry
  • Product code: SSC-176778
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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: ＞97%
  • 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 67127-91-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Beijing Inquiry

67127-91-7 / 2,5-bis(phenylmethoxy)benzoic acid

Standard CAS: 67127-91-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
67127-91-7
Multi CAS
No
Molecular Formula
C21H18O4
Molecular Weight
334.400000
Exact Mass
334.120509
InChI
InChI=1S/C21H18O4/c22-21(23)19-13-18(24-14-16-7-3-1-4-8-16)11-12-20(19)25-15-17-9-5-2-6-10-17/h1-13H,14-15H2,(H,22,23)
InChIKey
JCXIICUMJCMYAV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
18
Fraction Csp3
0.1
Rotatable bonds
7
H-bond acceptors
3
H-bond donors
1
Molar refractivity
94.95
TPSA
55.76

LogP / Solubility

WLOGP
4.54
MLOGP
4.01
XLogP3
4.4
Consensus LogP
4.32
Log S (ESOL)
-4.85
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.58
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.44
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)
-1.53

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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