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CAS 1754-49-0 Diethyl Phenylphosphonate molecular structure lightbox
CAS RN: 1754-49-0

Diethyl Phenylphosphonate

Product Availability

Choose a grade to view its available package options.

7 package records6 with current stock4 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251010 5ml / 25ml / 100ml Confirm by inquiry Shanghai, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260625 100ml In stock Inquiry
Batchno.20250115 1ml Out of stock Inquiry
Batchno.20250403 25ml In stock Inquiry
Batchno.20250725 5ml In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251018 5ml / 25ml / 100ml Confirm by inquiry Shandong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251110 1ml In stock Shandong Inquiry
  • Product code: SSC-076974
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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: 25g
  • 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 1754-49-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ＞97% 0 Out of Stock Shenzhen Inquiry

1754-49-0 / diethoxyphosphorylbenzene

Standard CAS: 1754-49-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1754-49-0
Multi CAS
No
Molecular Formula
C10H15O3P
Molecular Weight
214.200000
Exact Mass
214.075881
SMILES
CCOP(=O)(C1=CC=CC=C1)OCC
InChI
InChI=1S/C10H15O3P/c1-3-12-14(11,13-4-2)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3
InChIKey
VZEGPPPCKHRYGO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
5
H-bond acceptors
3
Molar refractivity
56.93
TPSA
35.53

LogP / Solubility

WLOGP
2.58
MLOGP
2.27
XLogP3
1.8
Consensus LogP
2.22
Log S (ESOL)
-2.78
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.18
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.79
Class (SILICOS-IT)
Poorly 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)
-2.2

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501

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