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CAS 195071-49-9 Amino-PEG4-CH2CO2H molecular structure lightbox
CAS RN: 195071-49-9

Amino-PEG4-CH2CO2H

  • Product code: SSC-091992
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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: 0.1g, 0.25g, 1g, 5g
  • Available purity: >98%
  • Inventory rows with stock: 3
  • 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 195071-49-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >98% 1 In Stock Shenzhen Inquiry
0.25g >98% 1 In Stock Hong Kong Inquiry
1g >98% 1 In Stock Shenzhen Inquiry
5g >98% 0 Out of Stock Shanghai Inquiry

195071-49-9 / 2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]acetic acid

Standard CAS: 195071-49-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
195071-49-9
Multi CAS
No
Molecular Formula
C10H21NO6
Molecular Weight
251.280000
Exact Mass
251.136887
SMILES
C(COCCOCCOCCOCC(=O)O)N
InChI
InChI=1S/C10H21NO6/c11-1-2-14-3-4-15-5-6-16-7-8-17-9-10(12)13/h1-9,11H2,(H,12,13)
InChIKey
NPRAKTLKDKKZAV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Fraction Csp3
0.9
Rotatable bonds
13
H-bond acceptors
6
H-bond donors
2
Molar refractivity
59.97
TPSA
100.24

LogP / Solubility

WLOGP
-0.9
MLOGP
-0.79
XLogP3
-4
Consensus LogP
-1.9
Log S (ESOL)
0.03
Class (ESOL)
Highly soluble
Log S (Ali)
-0.97
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-2.1
Class (SILICOS-IT)
Moderately 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)
-4.89

Drug-likeness / Medicinal Chemistry

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

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