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CAS 88778-21-6 2-(2-METHOXYETHOXY)ETHANETHIOL 97 molecular structure lightbox
CAS RN: 88778-21-6

2-(2-METHOXYETHOXY)ETHANETHIOL 97

  • Product code: SSC-200448
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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: >95%
  • Inventory rows with stock: 4
  • 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 88778-21-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 2 In Stock Shanghai Inquiry
0.25g >95% 2 In Stock Shenzhen Inquiry
1g >95% 2 In Stock Beijing Inquiry
5g >95% 2 In Stock Hong Kong Inquiry

88778-21-6 / 2-(2-methoxyethoxy)ethanethiol

Standard CAS: 88778-21-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
88778-21-6
Multi CAS
No
Molecular Formula
C5H12O2S
Molecular Weight
136.210000
Exact Mass
136.055801
InChI
InChI=1S/C5H12O2S/c1-6-2-3-7-4-5-8/h8H,2-5H2,1H3
InChIKey
CDBORKXXLPAUKJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
1
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
1
Molar refractivity
36.55
TPSA
18.46

LogP / Solubility

WLOGP
0.58
MLOGP
0.5
XLogP3
0.1
Consensus LogP
0.39
Log S (ESOL)
-0.72
Class (ESOL)
Very soluble
Log S (Ali)
-1.1
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.63
Class (SILICOS-IT)
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

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