| CAS Number | 64633-88-1 |
| Catalog Number | AG00ENT9(AGN-PC-0TDCJQ) |
| Chemical Name | 2-Nitrobenzene-1-carboximidamide hydrochloride |
| IUPAC Name | 2-nitrobenzenecarboximidamide;hydrochloride |
| InChI | InChI=1S/C7H7N3O2.ClH/c8-7(9)5-3-1-2-4-6(5)10(11)12;/h1-4H,(H3,8,9);1H |
| InChI Key | AUXXZZHQJXFJTC-UHFFFAOYSA-N |
| MDL Number | MFCD11617091 |
| Molecular Formula | C7H8ClN3O2 |
| Molecular Weight | 201.6103 |
| SMILES | Cl.NC(C1=C([N+]([O-])=O)C=CC=C1)=N |
| Synonyms | 64633-88-1,
BENZENECARBOXIMIDAMIDE,2-NITRO-,HYDROCHLORIDE,
2-nitrobenzene-1-carboximidamide hydrochloride,
nitroben-zamidine hydrochloride,
SCHEMBL698522,
2-nitrobenzamidine hydrochloride,
AUXXZZHQJXFJTC-UHFFFAOYSA-N,
2-nitrobenzenecarboximidamide HCl salt,
AKOS016367763,
MCULE-9421742783,
SC-61119,
Z2832012269,
|
| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.031g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.61g/mol |
| Monoisotopic Mass | 201.031g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 95.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number