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CAS 534-26-9 2-Methyl-2-imidazoline molecular structure lightbox
CAS RN: 534-26-9

2-Methyl-2-imidazoline

  • Product code: SSC-160733
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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: 10g
  • 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 534-26-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ＞97% 0 Out of Stock Hong Kong Inquiry

534-26-9 / 2-methyl-4,5-dihydro-1H-imidazole

Standard CAS: 534-26-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
534-26-9
Multi CAS
No
Molecular Formula
C4H8N2
Molecular Weight
84.120000
Exact Mass
84.068748
InChI
InChI=1S/C4H8N2/c1-4-5-2-3-6-4/h2-3H2,1H3,(H,5,6)
InChIKey
VWSLLSXLURJCDF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
0.75
H-bond acceptors
2
H-bond donors
1
Molar refractivity
25.98
TPSA
24.39

LogP / Solubility

WLOGP
0.01
MLOGP
-0.01
XLogP3
0.5
Consensus LogP
0.17
Log S (ESOL)
-0.37
Class (ESOL)
Very soluble
Log S (Ali)
-0.26
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.21
Class (SILICOS-IT)
Very 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)
-3.23

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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