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CAS 3279-54-7 Disodium Phenyl Phosphate Hydrate molecular structure lightbox
CAS RN: 3279-54-7

Disodium Phenyl Phosphate Hydrate

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251109 100g In stock Tianjin, Chengdu Inquiry
Batchno.20250928 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260202 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20251114 500g In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250501 5g In stock Shenzhen, Tianjin, Chengdu Inquiry
  • Product code: SSC-138478
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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 3279-54-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ＞97% 0 Out of Stock Beijing Inquiry

3279-54-7 / disodium;phenyl phosphate

Standard CAS: 3279-54-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
3279-54-7
Multi CAS
Yes
Molecular Formula
C6H5NA2O4P
Molecular Weight
218.050000
Exact Mass
217.972084
InChI
InChI=1S/C6H7O4P.2Na/c7-11(8,9)10-6-4-2-1-3-5-6;;/h1-5H,(H2,7,8,9);;/q;2*+1/p-2
InChIKey
TYJOJLOWRIQYQM-UHFFFAOYSA-L

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
34.68
TPSA
72.42

LogP / Solubility

WLOGP
-6.1
MLOGP
-5.36
XLogP3
-6.1
Consensus LogP
-5.85
Log S (ESOL)
2.44
Class (ESOL)
Highly soluble
Log S (Ali)
3.05
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
3.74
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-8.38

Drug-likeness / Medicinal Chemistry

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

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