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CAS 1192-34-3 1,3-Dihydro-4-methyl-2H-imidazol-2-one molecular structure lightbox
CAS RN: 1192-34-3

1,3-Dihydro-4-methyl-2H-imidazol-2-one

  • Product code: SSC-019684
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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: 1g
  • 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 1192-34-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

1192-34-3 / 4-methyl-1,3-dihydroimidazol-2-one

1,3-Dihydro-4-methyl-2H-imidazol-2-one | EINECS 214-751-9 | DTXSID60152337

Standard CAS: 1192-34-3 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1192-34-3
Multi CAS
Yes
Molecular Formula
C4H6N2O
Molecular Weight
98.100000
Exact Mass
98.048013
SMILES
CC1=CNC(=O)N1
InChI
InChI=1S/C4H6N2O/c1-3-2-5-4(7)6-3/h2H,1H3,(H2,5,6,7)
InChIKey
MCSCIFLXNFLCDV-UHFFFAOYSA-N
Synonyms
1,3-Dihydro-4-methyl-2H-imidazol-2-one EINECS 214-751-9 DTXSID60152337 NSC 186756 RefChem:72675

Computed Properties

Structural Parameters

Heavy atom count
7
Aromatic heavy atom count
5
Fraction Csp3
0.25
H-bond acceptors
1
H-bond donors
2
Molar refractivity
26.15
TPSA
48.65

LogP / Solubility

WLOGP
0.01
XLogP3
-0.5
Consensus LogP
-0.16
Log S (ESOL)
-0.98
Class (ESOL)
Very soluble
Log S (Ali)
-0.37
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.31
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)
-3.31

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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