| CAS Number | 68319-86-8 |
| Catalog Number | AG00IBTJ(AGN-PC-0WAJCZ) |
| Chemical Name | 5-Bromo-2-ethoxyaniline |
| IUPAC Name | 5-bromo-2-ethoxyaniline |
| InChI | InChI=1S/C8H10BrNO/c1-2-11-8-4-3-6(9)5-7(8)10/h3-5H,2,10H2,1H3 |
| InChI Key | VVSSUPLMPJIGNN-UHFFFAOYSA-N |
| MDL Number | MFCD00166972 |
| Molecular Formula | C8H10BrNO |
| Molecular Weight | 216.0751 |
| SMILES | CCOC1=C(N)C=C(Br)C=C1 |
| Synonyms | 5-BROMO-2-ETHOXYANILINE,
68319-86-8,
5-bromo-2-ethoxyphenylamine,
(5-bromo-2-ethoxyphenyl)amine hydrochloride,
CTK6G2447,
ALBB-026275,
MFCD08686988,
SBB072961,
ZINC14630928,
5-bromo-2-ethoxyaniline hydrochloride,
AKOS000214997,
MCULE-9943052005,
TR-047041,
BB 0241871,
ST45029656,
T3861,
EN300-68275,
Z-1269,
Z1263602405,
|
| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.078g/mol |
| Monoisotopic Mass | 214.995g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number