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1H-Benzimidazole-2-carboxaldehyde, 1-methyl, oxime (9CI) is a chemical compound with the molecular formula C9H10N2O. It is a derivative of benzimidazole, a heterocyclic aromatic organic compound consisting of a benzene ring fused to an imidazole ring. The compound features a methyl group at the 1-position, a formyl group at the 2-position, and an oxime group attached to the aldehyde. This specific arrangement of functional groups gives the compound unique chemical properties and potential applications in various fields, such as pharmaceuticals, agrochemicals, and materials science. The compound is also known by other names, including 1-methyl-1H-benzimidazole-2-carboxaldehyde oxime and 1-methylbenzimidazole-2-carboxaldehyde oxime.

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  • 3013-07-8 Structure
  • Basic information

    1. Product Name: 1H-Benzimidazole-2-carboxaldehyde,1-methyl-,oxime(9CI)
    2. Synonyms: 1H-Benzimidazole-2-carboxaldehyde,1-methyl-,oxime(9CI)
    3. CAS NO:3013-07-8
    4. Molecular Formula: C9H9N3O
    5. Molecular Weight: 175.19
    6. EINECS: N/A
    7. Product Categories: BENZIMIDAZOLE
    8. Mol File: 3013-07-8.mol
  • Chemical Properties

    1. Melting Point: 218 °C(Solv: acetone (67-64-1))
    2. Boiling Point: 249.7°Cat760mmHg
    3. Flash Point: 104.8°C
    4. Appearance: /
    5. Density: 1.27g/cm3
    6. Vapor Pressure: 0.0226mmHg at 25°C
    7. Refractive Index: 1.644
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. PKA: 10.34±0.30(Predicted)
    11. CAS DataBase Reference: 1H-Benzimidazole-2-carboxaldehyde,1-methyl-,oxime(9CI)(CAS DataBase Reference)
    12. NIST Chemistry Reference: 1H-Benzimidazole-2-carboxaldehyde,1-methyl-,oxime(9CI)(3013-07-8)
    13. EPA Substance Registry System: 1H-Benzimidazole-2-carboxaldehyde,1-methyl-,oxime(9CI)(3013-07-8)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 3013-07-8(Hazardous Substances Data)

3013-07-8 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 3013-07-8 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 3,0,1 and 3 respectively; the second part has 2 digits, 0 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 3013-07:
(6*3)+(5*0)+(4*1)+(3*3)+(2*0)+(1*7)=38
38 % 10 = 8
So 3013-07-8 is a valid CAS Registry Number.
InChI:InChI=1/C9H9N3O/c1-12-8-5-3-2-4-7(8)11-9(12)6-10-13/h2-6,11H,1H3/b9-6-

3013-07-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-methyl-1H-benzo[d]imidazole-2-carbaldehyde oxime

1.2 Other means of identification

Product number -
Other names 1-methyl-1H-benzoimidazole-2-carbaldehyde oxime

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:3013-07-8 SDS

3013-07-8Relevant articles and documents

SPIRO-OXADIAZOLINE COMPOUNDS AS AGONISTS OF α-7-NICOTINIC ACETYLCHOLINE RECEPTORS

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Paragraph 00300-00301, (2015/05/19)

The present invention relates to novel spiro-oxadiazoline compounds that are suitable as agonists or partial agonists of a7-nAChR, and pharmaceutical compositions of the same, methods of preparing these compounds and compositions, and the use of these compounds and compositions in methods of maintaining, treating and/or improving cognitive function. In particular, methods of administering a spiro-oxadiazoline cx7-nAChR agonist or partial agonist, to a patient in need thereof, for example a patient with a cognitive deficiency and/or a desire to enhance cognitive function, that may derive a benefit therefrom.

Mechanochemical and conformational study of N-heterocyclic carbonyl-oxime transformations

Primoi, Ines,Hrenar, Tomica,Baumann, Kreimir,Krito, Lucija,Krii, Ivana,Tomi, Srdlanka

, p. 153 - 160 (2015/02/19)

New mechanochemical pathways for the transformation of six N-heterocyclic carbonyl compounds into oximes using hydroxylamine hydrochloride were explored. Reactions were performed first without any base since the heterocyclic moieties (imidazole, benzimidazole, pyridine and quinuclidine) have an intrinsic basic nitrogen atom. This green, solvent free method was suitable for all compounds (up to quantitative yields) except for N-benzyl substituted imidazole and benzimidazole-2-carbaldehyde. For the slower reacting aldehydes, reactions with liquid assisted grinding and addition of sodium hydroxide were performed as well. Conformational analysis and quantum-chemical calculations revealed steric and electronic reasons for the lower reactivity of N-benzyl substituted derivatives.

2-(1H-INDAZOL-6-YLAMINO)-BENZAMIDE COMPOUNDS AS PROTEIN KINASES INHIBITORS USEFUL FOR THE TREATMENT OF OPHTALMIC DISEASES

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Page 72, (2010/02/07)

Indazole compounds that modulate and/or inhibit the ophthalmic diseases and the activity of certain protein kinases are described. These compounds and pharmaceutical compositions containing them are capable of mediating tyrosine kinase signal transduction and thereby modulate and/or inhibit unwanted cell proliferation. The invention is also directed to the therapeutic or prophylactic use of pharmaceutical compositions containing such compounds, and to methods of treating ophthalmic diseases and cancer and other disease states associated with unwanted angiogenesis and/or cellular proliferation, such as diabetic retinopathy, neovascular glaucoma,rheumatoid arthritis, and psoriasis, by administering effective amounts of such compounds.

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