| CAS Number | 1364699-31-9 |
| Catalog Number | AG009YIE(AGN-PC-0WCSHY) |
| Chemical Name | 4-(1-(3-Bromophenyl)ethyl)morpholine |
| IUPAC Name | 4-[1-(3-bromophenyl)ethyl]morpholine |
| InChI | InChI=1S/C12H16BrNO/c1-10(14-5-7-15-8-6-14)11-3-2-4-12(13)9-11/h2-4,9-10H,5-8H2,1H3 |
| InChI Key | KDWFLFIFJDRZLP-UHFFFAOYSA-N |
| MDL Number | MFCD23554997 |
| Molecular Formula | C12H16BrNO |
| Molecular Weight | 270.1655 |
| SMILES | CC(N1CCOCC1)C2=CC=CC(Br)=C2 |
| Synonyms | 4-(1-(3-bromophenyl)ethyl)morpholine,
1364699-31-9,
4-[1-(3-bromophenyl)ethyl]morpholine,
SCHEMBL8251020,
AKOS019917262,
AM86562,
4-(3-Bromo-alpha-methylbenzyl)morpholine,
AS-62546,
DA-21665,
FT-0730020,
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| Complexity | 194 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 269.04153g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.17g/mol |
| Monoisotopic Mass | 269.04153g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12.5Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number