(6-methyl-1H-benzimidazol-2-yl)methanol

Base Information

• Chemical Name: (6-methyl-1H-benzimidazol-2-yl)methanol
• CAS No.: 20034-02-0
• Molecular Formula: C9H10N2O
• Molecular Weight: 162.19
• Hs Code.: 2933990090
• European Community (EC) Number: 844-798-6
• DSSTox Substance ID: DTXSID70350448
• Wikidata: Q72487828
• ChEMBL ID: CHEMBL1873675
• Mol file: 20034-02-0.mol

Synonyms:20034-02-0;(6-methyl-1H-benzimidazol-2-yl)methanol;(6-Methyl-1H-benzoimidazol-2-yl)-methanol;(6-methyl-1H-benzo[d]imidazol-2-yl)methanol;(5-methyl-1H-benzimidazol-2-yl)methanol;(6-Methyl-1H-benzoimidazol-2-yl)methanol;(5-Methyl-1H-benzoimidazol-2-yl)-methanol;6-Methyl-1H-benzimidazole-2-methanol;(5-Methyl-1H-benzoimidazol-2-yl)methanol;1H-Benzimidazole-2-methanol, 6-methyl-;(5-methyl-1H-1,3-benzodiazol-2-yl)methanol;SCHEMBL2017392;CHEMBL1873675;SCHEMBL15947556;DTXSID70350448;MFCD01995823;STK392198;AKOS000272022;AKOS000286756;AB10486;DS-3448;NCGC00184545-01;NCGC00184545-02;AM803466;BB 0219450;BB 0256939;FT-0691061;(5-methyl-1H-benzo[d]imidazol-2-yl)methanol;2-(Hydroxymethyl)-6-methyl-1H-benzoimidazole;EN300-42306;VU0405939-2;(5-methyl-1H-1,3-benzimidazol-2-yl)methanol;AB01332847-02;A814191;AT-051/40445805;Z57370049;(6-Methyl-1H-benzoimidazol-2-yl)-methanol, AldrichCPR;F3257-0259

Chemical Property of (6-methyl-1H-benzimidazol-2-yl)methanol

Chemical Property:

• Vapor Pressure: 1.12E-07mmHg at 25°C
• Melting Point: 203 °C
• Refractive Index: 1.69
• Boiling Point: 416.3 °C at 760 mmHg
• PKA: 11.83±0.10(Predicted)
• Flash Point: 205.6 °C
• PSA: 48.91000
• Density: 1.295 g/cm³
• LogP: 1.36360
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 162.079312947
• Heavy Atom Count: 12
• Complexity: 163

Purity/Quality:

99%, ^*data from raw suppliers

(6-Methyl-1h-benzoimidazol-2-yl)-methanol ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 41
• Safety Statements: 26-39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1)N=C(N2)CO

Technology Process of (6-methyl-1H-benzimidazol-2-yl)methanol

There total 3 articles about (6-methyl-1H-benzimidazol-2-yl)methanol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%

glycolic Acid (79-14-1) + 4-methyl-1,2-diaminobenzene (496-72-0) → (5-methyl-1H-benzimidazole-2-yl)methanol (20034-02-0)

Guidance literature:

With hydrogenchloride; In water; for 3h; Reflux;

DOI:10.3390/molecules200815206

Reference yield: 88.0%

glycolic Acid (79-14-1) + 4-methyl-1,2-diaminobenzene (496-72-0) → (6-methyl-1H-benzoimidazol-2-yl)methanol (20034-02-0)

Guidance literature:

With hydrogenchloride; In water; Reflux;

Reference yield: 83.0%

C6H12O6 + 4-methyl-1,2-diaminobenzene (496-72-0) → (5-methyl-1H-benzimidazole-2-yl)methanol (20034-02-0)

Guidance literature:

With di-tert-butyl peroxide; boron trifluoride diethyl etherate; In decane; acetonitrile; at 90 ℃; for 1h; Green chemistry;

DOI:10.1002/asia.202100972

upstream raw materials:

glycolic Acid

4-methyl-1,2-diaminobenzene

Downstream raw materials:

C₉H₈N₂O

2-(hydroxymethyl)-1,6-dimethylbenzimidazole

(N-methyl-5-methyl-1H-benzimidazole-2-yl)methanol

1,5-dimethyl-1H-benzoimidazole-2-carbaldehyde

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