| CAS Number | 178063-34-8 |
| Catalog Number | AG01EHSH |
| Chemical Name | 1-[(2-fluorophenyl)methyl]guanidine hydrochloride |
| IUPAC Name | 2-[(2-fluorophenyl)methyl]guanidine;hydrochloride |
| InChI | InChI=1S/C8H10FN3.ClH/c9-7-4-2-1-3-6(7)5-12-8(10)11;/h1-4H,5H2,(H4,10,11,12);1H |
| InChI Key | DIEKILBSZMWGBM-UHFFFAOYSA-N |
| MDL Number | MFCD31615946 |
| Molecular Formula | C8H11ClFN3 |
| Molecular Weight | 203.6444 |
| SMILES | Cl.NC(NCC1=C(F)C=CC=C1)=N |
| Synonyms | 1-[(2-fluorophenyl)methyl]guanidine hydrochloride,
178063-34-8,
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.645g/mol |
| Monoisotopic Mass | 203.063g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 64.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
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