[email protected]
CAS 118988-04-8 ethyl 2-(2-(2-(2-hydroxyethoxy)ethoxy)ethoxy)acetate molecular structure lightbox
CAS RN: 118988-04-8

ethyl 2-(2-(2-(2-hydroxyethoxy)ethoxy)ethoxy)acetate

  • Product code: SSC-019209
GET A QUOTE
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
Request Bulk Quote

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 118988-04-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

118988-04-8 / ethyl 2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]acetate

Hydroxy-PEG3-ethyl acetate | Acetic acid, [2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]-, ethyl ester | ethyl 2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]acetate

Standard CAS: 118988-04-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
118988-04-8
Multi CAS
No
Molecular Formula
C10H20O6
Molecular Weight
236.260000
Exact Mass
236.125988
SMILES
CCOC(=O)COCCOCCOCCO
InChI
InChI=1S/C10H20O6/c1-2-16-10(12)9-15-8-7-14-6-5-13-4-3-11/h11H,2-9H2,1H3
InChIKey
PBLJUNKNKQCNPA-UHFFFAOYSA-N
Synonyms
Hydroxy-PEG3-ethyl acetate Acetic acid, [2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]-, ethyl ester ethyl 2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]acetate HO-PEG3-CH2COOEt ethyl 2-(2-(2-(2-hydroxyethoxy)ethoxy)ethoxy)-acetate

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
0.9
Rotatable bonds
11
H-bond acceptors
6
H-bond donors
1
Molar refractivity
56.18
TPSA
74.22

LogP / Solubility

WLOGP
-0.41
MLOGP
-0.36
XLogP3
-0.6
Consensus LogP
-0.46
Log S (ESOL)
-0.32
Class (ESOL)
Very soluble
Log S (Ali)
-1.2
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.18
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
Low
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)
-4.45

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

Customers Also Viewed

Get In Touch

Contact Us