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CAS 90965-06-3 Dimethyl (1-Diazo-2-oxopropyl)phosphonate molecular structure lightbox
CAS RN: 90965-06-3

Dimethyl (1-Diazo-2-oxopropyl)phosphonate

  • Product code: SSC-203718
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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: 1g, 5g, 10g, 25g, 100g
  • Available purity: >95%
  • Inventory rows with stock: 5
  • 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 90965-06-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 5 In Stock Shanghai Inquiry
5g >95% 5 In Stock Shenzhen Inquiry
10g >95% 5 In Stock Beijing Inquiry
25g >95% 5 In Stock Shenzhen Inquiry
100g >95% 5 In Stock Shenzhen Inquiry

90965-06-3 / 1-[dimethoxy(oxido)-lambda5-phosphanylidene]-2-oxopropane-1-diazonium

Standard CAS: 90965-06-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
90965-06-3
Multi CAS
Yes
Molecular Formula
C5H9N2O4P
Molecular Weight
192.110000
Exact Mass
192.029994
InChI
InChI=1S/C5H9N2O4P/c1-4(8)5(7-6)12(9,10-2)11-3/h1-3H3
InChIKey
SQHSJJGGWYIFCD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.6
Rotatable bonds
3
H-bond acceptors
5
Molar refractivity
41.71
TPSA
86.74

LogP / Solubility

WLOGP
-0.03
MLOGP
-0.02
XLogP3
-0.5
Consensus LogP
-0.18
Log S (ESOL)
-0.82
Class (ESOL)
Very soluble
Log S (Ali)
-1.12
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.25
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
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)
-3.91

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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