| CAS Number | 915920-60-4 |
| Catalog Number | AG00GVPU |
| Chemical Name | [2-(3-Bromophenoxy)ethyl](ethyl)amine |
| IUPAC Name | 2-(3-bromophenoxy)-N-ethylethanamine |
| InChI | InChI=1S/C10H14BrNO/c1-2-12-6-7-13-10-5-3-4-9(11)8-10/h3-5,8,12H,2,6-7H2,1H3 |
| InChI Key | BAOBUDYZENCVBI-UHFFFAOYSA-N |
| MDL Number | MFCD08069455 |
| Molecular Formula | C10H14BrNO |
| Molecular Weight | 244.1283 |
| SMILES | C1C(=CC=CC=1Br)OCCNCC |
| Synonyms | [2-(3-bromophenoxy)ethyl]ethylamine hydrochloride,
[2-(3-BROMOPHENOXY)ETHYL](ETHYL)AMINE,
915920-60-4,
AC1O5N1S,
ZINC6703620,
ZX-CM017728,
2-(3-bromophenoxy)-N-ethylethanamine,
AKOS009062460,
AJ-56720,
Y-3683,
2-(3-bromophenoxy)-N-ethyl-ethanamine,
CID6460558,
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| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 243.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.132g/mol |
| Monoisotopic Mass | 243.026g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number