| CAS Number | 122712-58-7 |
| Catalog Number | AG00J1R2(AGN-PC-0PGKZP) |
| Chemical Name | Ethyl (3-aminophenyl)carbamate hydrochloride |
| IUPAC Name | ethyl N-(3-aminophenyl)carbamate;hydrochloride |
| InChI | InChI=1S/C9H12N2O2.ClH/c1-2-13-9(12)11-8-5-3-4-7(10)6-8;/h3-6H,2,10H2,1H3,(H,11,12);1H |
| InChI Key | QMFTYUPBCCAAPO-UHFFFAOYSA-N |
| MDL Number | MFCD13194003 |
| Molecular Formula | C9H13ClN2O2 |
| Molecular Weight | 216.6647 |
| SMILES | C(OCC)(=O)NC1=CC=CC(N)=C1.Cl |
| Synonyms | ethyl (3-aminophenyl)carbamate hydrochloride,
122712-58-7,
ethyl (3-aminophenyl)carbamate HCl,
ZX-CM005860,
MFCD13194003,
AKOS034834169,
MCULE-8986706107,
Ethyl(3-aminophenyl)carbamate hydrochloride,
4027008-25G,
Ethyl (3-aminophenyl)carbamate hydrochloride, AldrichCPR,
3-Amino-phenylcarbaminsaeureethylester-Hydrochlorid,
68621-73-8,
|
| Complexity | 173 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.665g/mol |
| Monoisotopic Mass | 216.067g/mol |
| Rotatable Bond Count | 3 |
| 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
Lot Number