| CAS Number | 3878-22-6 |
| Catalog Number | AG00CWNH(AGN-PC-0JP0K4) |
| Chemical Name | 2-(furan-3-yl)-1H-1,3-benzodiazole |
| IUPAC Name | 2-(furan-3-yl)-1H-benzimidazole |
| InChI | InChI=1S/C11H8N2O/c1-2-4-10-9(3-1)12-11(13-10)8-5-6-14-7-8/h1-7H,(H,12,13) |
| InChI Key | KWLRSTOWOUHFQP-UHFFFAOYSA-N |
| MDL Number | MFCD01014196 |
| Molecular Formula | C11H8N2O |
| Molecular Weight | 184.1940 |
| NSC Number | 283172 |
| SMILES | C1OC=C(C2NC3=C(C=CC=C3)N=2)C=1 |
| Synonyms | 2-(furan-3-yl)-1H-1,3-benzodiazole,
3878-22-6,
NSC283172,
2-(furan-3-yl)-1H-benzo[d]imidazole,
AC1Q4V8D,
AC1L88J7,
SCHEMBL3336782,
2-(3-furyl)-1h-benzimidazole,
CTK5J7844,
DTXSID40314431,
2-(furan-3-yl)-1H-benzimidazole,
ZINC13207305,
AKOS009356319,
NE26286,
NSC-283172,
1H-Benzimidazole,2-(3-furanyl)-(9CI),
EN300-59913,
CID323391,
|
| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.198g/mol |
| Monoisotopic Mass | 184.064g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number