| CAS Number | 50591-23-6 |
| Catalog Number | AG00DWFQ(AGN-PC-0S8N42) |
| Chemical Name | 1H-Benzimidazol-6-ol,1-methyl-(9CI) |
| IUPAC Name | 3-methylbenzimidazol-5-ol |
| InChI | InChI=1S/C8H8N2O/c1-10-5-9-7-3-2-6(11)4-8(7)10/h2-5,11H,1H3 |
| InChI Key | LPSCFCRUNJXWME-UHFFFAOYSA-N |
| MDL Number | MFCD18807402 |
| Molecular Formula | C8H8N2O |
| Molecular Weight | 148.1619 |
| SMILES | Oc1ccc2c(c1)n(C)cn2 |
| Synonyms | 1-methyl-1H-benzo[d]imidazol-6-ol,
50591-23-6,
SCHEMBL4081614,
1-methyl-6-hydroxybenzimidazole,
3-methyl-3H-benzoimidazol-5-ol,
LPSCFCRUNJXWME-UHFFFAOYSA-N,
1H-Benzimidazol-6-ol,1-methyl-(9CI),
|
| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 148.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 148.165g/mol |
| Monoisotopic Mass | 148.064g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number