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CAS 1263046-77-0 Amino-PEG2-(CH2)3CO2H molecular structure lightbox
CAS RN: 1263046-77-0

Amino-PEG2-(CH2)3CO2H

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251115 250mg Out of stock 15 business days Inquiry
  • Product code: SSC-033290
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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: 0.25g, 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 1263046-77-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

1263046-77-0 / 4-[2-(2-aminoethoxy)ethoxy]butanoic acid

Standard CAS: 1263046-77-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1263046-77-0
Multi CAS
No
Molecular Formula
C8H17NO4
Molecular Weight
191.220000
Exact Mass
191.115758
SMILES
C(CC(=O)O)COCCOCCN
InChI
InChI=1S/C8H17NO4/c9-3-5-13-7-6-12-4-1-2-8(10)11/h1-7,9H2,(H,10,11)
InChIKey
CDXINNRZABLVDW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
0.88
Rotatable bonds
9
H-bond acceptors
4
H-bond donors
2
Molar refractivity
47.56
TPSA
81.78

LogP / Solubility

WLOGP
-0.16
MLOGP
-0.14
XLogP3
-3.4
Consensus LogP
-1.23
Log S (ESOL)
-0.33
Class (ESOL)
Very soluble
Log S (Ali)
-1.01
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.85
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)
-4

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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