| CAS Number | 1256793-73-3 |
| Catalog Number | AG000OD4(AGN-PC-0WOLRW) |
| Chemical Name | 1-(5-bromo-2-pyridinyl)Cyclobutanamine |
| IUPAC Name | 1-(5-bromopyridin-2-yl)cyclobutan-1-amine |
| InChI | InChI=1S/C9H11BrN2/c10-7-2-3-8(12-6-7)9(11)4-1-5-9/h2-3,6H,1,4-5,11H2 |
| InChI Key | HNFGZABZRQMKMQ-UHFFFAOYSA-N |
| MDL Number | MFCD18258998 |
| Molecular Formula | C9H11BrN2 |
| Molecular Weight | 227.1010 |
| SMILES | NC1(C2=NC=C(Br)C=C2)CCC1 |
| Synonyms | 1-(5-Bromopyridin-2-yl)cyclobutanamine,
1256793-73-3,
SCHEMBL881806,
AKOS030632364,
1-(5-bromo-2-pyridinyl)cyclobutanamine,
1-(5-bromopyridin-2-yl)cyclobutan-1-amine,
Cyclobutanamine, 1-(5-bromo-2-pyridinyl)-,
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| Complexity | 168 |
| 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 | 1 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
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