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CAS 6303-28-2 2-ethylbutoxyphosphonic acid molecular structure lightbox
CAS RN: 6303-28-2

2-ethylbutoxyphosphonic acid

  • Product code: SSC-172526
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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: 1g
  • Available purity: ≥95%
  • 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 6303-28-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

6303-28-2 / 2-ethylbutyl dihydrogen phosphate

Standard CAS: 6303-28-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
6303-28-2
Multi CAS
Yes
Molecular Formula
C6H15O4P
Molecular Weight
182.150000
Exact Mass
182.070796
InChI
InChI=1S/C6H15O4P/c1-3-6(4-2)5-10-11(7,8)9/h6H,3-5H2,1-2H3,(H2,7,8,9)
InChIKey
WPNUQLDHLOBXJW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
5
H-bond acceptors
2
H-bond donors
2
Molar refractivity
42.07
TPSA
66.76

LogP / Solubility

WLOGP
1.53
MLOGP
1.35
XLogP3
0.5
Consensus LogP
1.13
Log S (ESOL)
-1.6
Class (ESOL)
Soluble
Log S (Ali)
-2.16
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.72
Class (SILICOS-IT)
Moderately 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)
-2.74

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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