| CAS Number | 1375068-93-1 |
| Catalog Number | AG009WYT(AGN-PC-0WA69X) |
| Chemical Name | 2-Bromo-6-(piperidin-1-yl)benzaldehyde |
| IUPAC Name | 2-bromo-6-piperidin-1-ylbenzaldehyde |
| InChI | InChI=1S/C12H14BrNO/c13-11-5-4-6-12(10(11)9-15)14-7-2-1-3-8-14/h4-6,9H,1-3,7-8H2 |
| InChI Key | CYJFFLDTXNACNN-UHFFFAOYSA-N |
| MDL Number | MFCD22205830 |
| Molecular Formula | C12H14BrNO |
| Molecular Weight | 268.1497 |
| SMILES | O=Cc1c(Br)cccc1N1CCCCC1 |
| Synonyms | 2-Bromo-6-(piperidin-1-yl)benzaldehyde,
1375068-93-1,
ACMC-209cd9,
CTK8B0653,
DTXSID70742985,
ANW-20299,
MFCD22205830,
ZINC85477224,
AJ-127826,
TC-109044,
V2745,
B-8861,
C12H14BrNO,
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| Complexity | 216 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 268.154g/mol |
| Monoisotopic Mass | 267.026g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number