ChemicalBook--->CAS DataBase List--->614-97-1

614-97-1

614-97-1 Structure

614-97-1 Structure
IdentificationMore
[Name]

5-Methylbenzimidazole
[CAS]

614-97-1
[Synonyms]

5-METHYL-1H-BENZIMIDAZOLE
5-METHYLBENZIMIDAZOLE
5-METHYLBENZOIMIDAZOLE
5(or6)-methyl-benzimidazol
5-methyl-1h-benzimidazol
5-methyl-benzimidazol
5-Methylbenzimidazole,98%
1H-Benzimidazole,5-methyl-(9CI)
1H-Benzimidazole, 6-methyl-
1H-Benzimidazole, 5-methyl-
6-Methyl-1H-benzimidazole
[EINECS(EC#)]

210-401-4
[Molecular Formula]

C8H8N2
[MDL Number]

MFCD00010740
[Molecular Weight]

132.16
[MOL File]

614-97-1.mol
Chemical PropertiesBack Directory
[Appearance]

OFF-WHITE POWDER
[Melting point ]

114-117 °C (lit.)
[Boiling point ]

169-172 °C/1 mmHg (lit.)
[density ]

1.1083 (rough estimate)
[refractive index ]

1.6013 (estimate)
[Fp ]

169-172°C/1mm
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Soluble in chloroform (25mg/ml).
[form ]

powder to crystaline
[pka]

13.15±0.30(Predicted)
[color ]

Light yellow to Brown to Dark green
[Detection Methods]

HPLC,NMR
[BRN ]

2628
[InChI]

1S/C8H8N2/c1-6-2-3-7-8(4-6)10-5-9-7/h2-5H,1H3,(H,9,10)
[InChIKey]

RWXZXCZBMQPOBF-UHFFFAOYSA-N
[SMILES]

Cc1ccc2[nH]cnc2c1
[CAS DataBase Reference]

614-97-1(CAS DataBase Reference)
[NIST Chemistry Reference]

5-Methylbenzimidazole(614-97-1)
[EPA Substance Registry System]

614-97-1(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R22:Harmful if swallowed.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[RTECS ]

DD9275000
[TSCA ]

Yes
[HS Code ]

29332900
[Storage Class]

11 - Combustible Solids
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

5-Methylbenzimidazole(614-97-1).msds
Hazard InformationBack Directory
[Chemical Properties]

OFF-WHITE POWDER
[Uses]

5-Methylbenzimidazole is used as a camphor substitute. It is also used as fine chemical and medicine intermediate.
[Definition]

ChEBI: 5-methyl-1H-benzimidazole is a member of the class of imidazoles that is 1H-benzimidazole in which the hydrogen at position 5 is substituted by a methyl group. It derives from a hydride of a 1H-benzimidazole.
[General Description]

The FT-IR and FT-Raman spectra of 5-methylbenzimidazole was investigated by density functional theory.
Spectrum DetailBack Directory
[Spectrum Detail]

5-Methylbenzimidazole(614-97-1)1HNMR
5-Methylbenzimidazole(614-97-1)IR
5-Methylbenzimidazole(614-97-1)Raman
5-Methylbenzimidazole(614-97-1)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

5-Methyl-1H-benzimidazole, 98%(614-97-1)
[Alfa Aesar]

5-Methylbenzimidazole, 98%(614-97-1)
[Sigma Aldrich]

614-97-1(sigmaaldrich)
[TCI AMERICA]

5-Methylbenzimidazole,>98.0%(T)(614-97-1)
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