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CAS 65894-83-9 2-Isobutyl-4,5-dimethyl-3-thiazoline (mixture of isomers) molecular structure lightbox
CAS RN: 65894-83-9

2-Isobutyl-4,5-dimethyl-3-thiazoline (mixture of isomers)

Product Availability

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4 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250421 100g Out of stock Inquiry
Batchno.20250514 25g In stock Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251126 5g In stock Shenzhen, Tianjin Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250403 1g / 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong, Chongqing Inquiry
  • Product code: SSC-175509
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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: 25g
  • 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 65894-83-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥95% 0 Out of Stock Beijing Inquiry

65894-83-9 / 4,5-dimethyl-2-(2-methylpropyl)-2,5-dihydro-1,3-thiazole

Standard CAS: 65894-83-9 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
65894-83-9
Multi CAS
No
Molecular Formula
C9H17NS
Molecular Weight
171.310000
Exact Mass
171.108171
InChI
InChI=1S/C9H17NS/c1-6(2)5-9-10-7(3)8(4)11-9/h6,8-9H,5H2,1-4H3
InChIKey
FDOISHJOXPONIV-UHFFFAOYSA-N

Physical Properties

Density
0.933-0.937
Physical Description
Clear to amber liquid; meaty, spicy, herbaceous odour
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.89
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
53.41
TPSA
12.36

LogP / Solubility

WLOGP
2.95
MLOGP
2.6
XLogP3
2.6
Consensus LogP
2.72
Log S (ESOL)
-2.63
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.1
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.47
Class (SILICOS-IT)
Poorly 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)
-1.67

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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