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CAS 1002-67-1 Diethylene Glycol Ethyl Methyl Ether molecular structure lightbox
CAS RN: 1002-67-1

Diethylene Glycol Ethyl Methyl Ether

  • Product code: SSC-000628
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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: 100g
  • Available purity: ≥97%
  • 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 1002-67-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥97% 0 Out of Stock Beijing Inquiry

1002-67-1 / 1-(2-ethoxyethoxy)-2-methoxyethane

1-ETHOXY-2-(2-METHOXYETHOXY)ETHANE | Diethylene glycol ethyl methyl ether | Ethane, 1-ethoxy-2-(2-methoxyethoxy)-

Standard CAS: 1002-67-1 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1002-67-1
Multi CAS
Yes
Molecular Formula
C7H16O3
Molecular Weight
148.200000
Exact Mass
148.109944
SMILES
CCOCCOCCOC
InChI
InChI=1S/C7H16O3/c1-3-9-6-7-10-5-4-8-2/h3-7H2,1-2H3
InChIKey
CNJRPYFBORAQAU-UHFFFAOYSA-N
Synonyms
1-ETHOXY-2-(2-METHOXYETHOXY)ETHANE Diethylene glycol ethyl methyl ether Ethane, 1-ethoxy-2-(2-methoxyethoxy)- diethylene glycol methyl ethyl ether 1-(2-ethoxyethoxy)-2-methoxyethane

Physical Properties

Physical Description
Liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
7
H-bond acceptors
3
Molar refractivity
39.19
TPSA
27.69

LogP / Solubility

WLOGP
0.69
MLOGP
0.6
Consensus LogP
0.43
Log S (ESOL)
-0.73
Class (ESOL)
Very soluble
Log S (Ali)
-1.27
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.03
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)
-3.14

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H319 (11.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264+P265, P280, P305+P351+P338, and P337+P317

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