| CAS Number | 1183473-03-1 |
| Catalog Number | AG00HEHM(AGN-PC-0DNK5E) |
| Chemical Name | 4-fluoro-1-methylbenzimidazol-2-amine |
| IUPAC Name | 4-fluoro-1-methylbenzimidazol-2-amine |
| InChI | InChI=1S/C8H8FN3/c1-12-6-4-2-3-5(9)7(6)11-8(12)10/h2-4H,1H3,(H2,10,11) |
| InChI Key | HZIBSZDHRLAIOV-UHFFFAOYSA-N |
| MDL Number | MFCD12149741 |
| Molecular Formula | C8H8FN3 |
| Molecular Weight | 165.1676 |
| SMILES | CN1C2=CC=CC(F)=C2N=C1N |
| Synonyms | 2-Amino-4-fluoro-1-methylbenzimidazole,
1183473-03-1,
4-fluoro-1-methyl-1H-1,3-benzodiazol-2-amine,
4-Fluoro-1-methyl-1H-benzo[d]imidazol-2-amine,
6158AJ,
MFCD12149741,
ZINC37421061,
4-fluoro-1-methylbenzimidazol-2-amine,
AKOS010005013,
MCULE-4724526808,
NE40819,
RP22788,
SY027891,
MFCD12149741 (95%),
C8H8FN3,
N/A,
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| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.171g/mol |
| Monoisotopic Mass | 165.07g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number