| CAS Number | 912482-43-0 |
| Catalog Number | AG00IGK2(AGN-PC-0WG3WE) |
| Chemical Name | 1-(4-(Bromomethyl)Piperidin-1-Yl)Ethanone |
| IUPAC Name | 1-[4-(bromomethyl)piperidin-1-yl]ethanone |
| InChI | InChI=1S/C8H14BrNO/c1-7(11)10-4-2-8(6-9)3-5-10/h8H,2-6H2,1H3 |
| InChI Key | VYMGDPNTLNUOHM-UHFFFAOYSA-N |
| MDL Number | MFCD11612753 |
| Molecular Formula | C8H14BrNO |
| Molecular Weight | 220.1069 |
| SMILES | BrCC1CCN(CC1)C(C)=O |
| Synonyms | 1-(4-Bromomethyl-piperidin-1-yl)-ethanone,
912482-43-0,
1-(4-(Bromomethyl)piperidin-1-yl)ethanone,
1-(4-Bromomethylpiperidin-1-yl)ethanone,
1-[4-(bromomethyl)piperidin-1-yl]ethanone,
SCHEMBL12747180,
1-Acetyl-4-(bromomethyl)piperidine,
MFCD11612753,
ZINC19783764,
AKOS017560885,
AM805849,
AS-39629,
CS-0039136,
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| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.11g/mol |
| Monoisotopic Mass | 219.026g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H319
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Packing Group
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Precautionary statements
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P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number