| CAS Number | 1255635-03-0 |
| Catalog Number | AG01AS4H |
| Chemical Name | [2-(pyridin-4-yl)pyridin-3-yl]methanamine |
| IUPAC Name | (2-pyridin-4-ylpyridin-3-yl)methanamine |
| InChI | InChI=1S/C11H11N3/c12-8-10-2-1-5-14-11(10)9-3-6-13-7-4-9/h1-7H,8,12H2 |
| InChI Key | LSEJIFXLXYCLKS-UHFFFAOYSA-N |
| MDL Number | MFCD17677603 |
| Molecular Formula | C11H11N3 |
| Molecular Weight | 185.2251 |
| SMILES | NCC1=C(C2=CC=NC=C2)N=CC=C1 |
| Synonyms | {[2,4'-bipyridine]-3-yl}methanamine,
[2,4'-bipyridin]-3-ylmethanamine,
1255635-03-0,
AKOS026681399,
ZINC215679676,
[2-(pyridin-4-yl)pyridin-3-yl]methanamine,
F2167-2375,
(2-pyridin-4-ylpyridin-3-yl)methanamine,
N/A,
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.23g/mol |
| Monoisotopic Mass | 185.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
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Certificate of Analysis
Lot Number