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CAS 7659-86-1 2-Ethylhexyl Thioglycolate molecular structure lightbox
CAS RN: 7659-86-1

2-Ethylhexyl Thioglycolate

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260430 100g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250524 1kg In stock Shanghai Inquiry
Batchno.20260305 25g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260313 500g In stock Shanghai Inquiry
  • Product code: ICTT0612
  • Purity/Analytical Methods: >98.0%(GC)
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7659-86-1 / 2-ethylhexyl 2-sulfanylacetate

Standard CAS: 7659-86-1 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
7659-86-1
Multi CAS
Yes
Molecular Formula
C10H20O2S
Molecular Weight
204.330000
Exact Mass
204.118401
InChI
InChI=1S/C10H20O2S/c1-3-5-6-9(4-2)7-12-10(11)8-13/h9,13H,3-8H2,1-2H3
InChIKey
OWHSTLLOZWTNTQ-UHFFFAOYSA-N

Physical Properties

Physical Description
Liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
0.9
Rotatable bonds
7
H-bond acceptors
3
H-bond donors
1
Molar refractivity
58.12
TPSA
26.3

LogP / Solubility

WLOGP
2.68
MLOGP
2.36
XLogP3
3.6
Consensus LogP
2.88
Log S (ESOL)
-2.33
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.17
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.05
Class (SILICOS-IT)
Slightly 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)
-2.07

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2

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