| CAS Number | 1289386-62-4 |
| Catalog Number | AG000YLX(AGN-PC-0WBRF2) |
| Chemical Name | (2-Bromo-pyridin-4-ylmethyl)-cyclopropyl-amine |
| IUPAC Name | N-[(2-bromopyridin-4-yl)methyl]cyclopropanamine |
| InChI | InChI=1S/C9H11BrN2/c10-9-5-7(3-4-11-9)6-12-8-1-2-8/h3-5,8,12H,1-2,6H2 |
| InChI Key | RJVPEXQFZWPSES-UHFFFAOYSA-N |
| MDL Number | MFCD18837160 |
| Molecular Formula | C9H11BrN2 |
| Molecular Weight | 227.1010 |
| SMILES | BrC1=NC=CC(CNC2CC2)=C1 |
| Synonyms | 1289386-62-4,
N-((2-Bromopyridin-4-yl)methyl)cyclopropanamine,
(2-BROMO-PYRIDIN-4-YLMETHYL)-CYCLOPROPYL-AMINE,
N-[(2-bromopyridin-4-yl)methyl]cyclopropanamine,
SCHEMBL15260148,
DTXSID60693770,
MFCD18837160,
ZINC66322945,
AKOS015940238,
AM91581,
FCH1346368,
AK-51844,
AB1009956,
AJ-115912,
ST24048229,
C-2581,
N-((2-Bromopyridin-4-yl)methyl)cyclopropylamine,
A1-12611,
null,
2-bromo-N-cyclopropyl-4-Pyridinemethanamine,
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| Complexity | 148 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.105g/mol |
| Monoisotopic Mass | 226.011g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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