| CAS Number | 1837-49-6 |
| Catalog Number | AG00ACX3(AGN-PC-0NBWGC) |
| Chemical Name | 1-Methyl-4,5,6,7-tetrahydro-1H-benzimidazole |
| IUPAC Name | 1-methyl-4,5,6,7-tetrahydrobenzimidazole |
| InChI | InChI=1S/C8H12N2/c1-10-6-9-7-4-2-3-5-8(7)10/h6H,2-5H2,1H3 |
| InChI Key | OBEFWOVHXQTYJK-UHFFFAOYSA-N |
| MDL Number | MFCD09837142 |
| Molecular Formula | C8H12N2 |
| Molecular Weight | 136.1943 |
| SMILES | N1C2CCCCC=2N(C)C=1 |
| Synonyms | 1-METHYL-4,5,6,7-TETRAHYDRO-1H-BENZIMIDAZOLE,
1837-49-6,
1-Methyl-4,5,6,7-tetrahydro-1H-benzo[d]imidazole,
SCHEMBL2402912,
DTXSID90446312,
MFCD09837142,
ZINC19091573,
AKOS000320130,
Y-5597,
CID10866391,
1-methyl-4,5,6,7-tetrahydrobenzoimidazole,
|
| Complexity | 124 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 136.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 136.198g/mol |
| Monoisotopic Mass | 136.1g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number