| CAS Number | 663941-79-5 |
| Catalog Number | AG00FLK5(AGN-PC-07HBPO) |
| Chemical Name | [2-(4-Bromophenoxy)ethyl]amine hydrochloride |
| IUPAC Name | 2-(4-bromophenoxy)ethanamine;hydrochloride |
| InChI | InChI=1S/C8H10BrNO.ClH/c9-7-1-3-8(4-2-7)11-6-5-10;/h1-4H,5-6,10H2;1H |
| InChI Key | NYTNYFFFMUXATL-UHFFFAOYSA-N |
| MDL Number | MFCD12547053 |
| Molecular Formula | C8H11BrClNO |
| Molecular Weight | 252.5360 |
| SMILES | C1(C=CC(OCCN)=CC=1)Br.Cl |
| Synonyms | 663941-79-5,
[2-(4-bromophenoxy)ethyl]amine hydrochloride,
1-(2-aminoethoxy)-4-bromobenzene hydrochloride,
2-(4-BROMOPHENOXY)ETHANAMINE HYDROCHLORIDE,
2-(4-bromophenoxy)ethan-1-amine hydrochloride,
AC1Q3DEL,
CTK7E9125,
7657AE,
MFCD12547053,
AKOS005256955,
MCULE-3318884969,
NE15520,
EN300-58876,
Z1262237188,
C8H11BrClNO,
26583-55-1,
|
| Complexity | 102 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 250.971g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 252.536g/mol |
| Monoisotopic Mass | 250.971g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number