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CAS 39799-77-4 1-Methyl-1,3-dihydro-imidazol-2-one molecular structure lightbox
CAS RN: 39799-77-4

1-Methyl-1,3-dihydro-imidazol-2-one

Product Availability

Choose a grade to view its available package options.

5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250505 100mg In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260118 10g In stock Shanghai Inquiry
Batchno.20260216 1g In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20250118 250mg In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260213 5g In stock Shanghai Inquiry
  • Product code: SSC-147542
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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 39799-77-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 2 In Stock Shenzhen Inquiry
0.25g >95% 2 In Stock Shanghai Inquiry
1g >95% 2 In Stock Beijing Inquiry
5g >95% 1 In Stock Hong Kong Inquiry

39799-77-4 / 3-methyl-1H-imidazol-2-one

Standard CAS: 39799-77-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
39799-77-4
Multi CAS
No
Molecular Formula
C4H6N2O
Molecular Weight
98.100000
Exact Mass
98.048013
InChI
InChI=1S/C4H6N2O/c1-6-3-2-5-4(6)7/h2-3H,1H3,(H,5,7)
InChIKey
PXHFWPOPKVWXQT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Aromatic heavy atom count
5
Fraction Csp3
0.25
H-bond acceptors
2
H-bond donors
1
Molar refractivity
26.03
TPSA
37.79

LogP / Solubility

WLOGP
-0.29
MLOGP
-0.26
XLogP3
-0.9
Consensus LogP
-0.48
Log S (ESOL)
-0.8
Class (ESOL)
Very soluble
Log S (Ali)
-0.16
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.06
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)
-3.52

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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