| CAS Number | 1133116-11-6 |
| Catalog Number | AG0079F3(AGN-PC-0WA94S) |
| Chemical Name | 4-(3-(3-Bromophenyl)Propyl)Morpholine |
| IUPAC Name | 4-[3-(3-bromophenyl)propyl]morpholine |
| InChI | InChI=1S/C13H18BrNO/c14-13-5-1-3-12(11-13)4-2-6-15-7-9-16-10-8-15/h1,3,5,11H,2,4,6-10H2 |
| InChI Key | BRDFMYRGMMWEOR-UHFFFAOYSA-N |
| MDL Number | MFCD11855932 |
| Molecular Formula | C13H18BrNO |
| Molecular Weight | 284.1921 |
| SMILES | Brc1cccc(c1)CCCN1CCOCC1 |
| Synonyms | 4-(3-(3-Bromophenyl)propyl)morpholine,
1133116-11-6,
4-[3-(3-bromophenyl)propyl]morpholine,
ACMC-2099j1,
SCHEMBL1651281,
CTK4A8241,
DTXSID60675031,
ANW-16619,
MFCD11855932,
ZINC38537502,
AKOS015834657,
RTR-002574,
AJ-96150,
AX8229608,
TR-002574,
ST24023133,
Z7456,
A-5008,
I14-24924,
C13H18BrNO,
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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 | 283.057g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 284.197g/mol |
| Monoisotopic Mass | 283.057g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 12.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number