| CAS Number | 1820650-93-8 |
| Catalog Number | AG00I0PE |
| Chemical Name | 3-[2-(Benzyloxy)ethoxy]-5-chloropyridin-2-amine |
| IUPAC Name | 5-chloro-3-(2-phenylmethoxyethoxy)pyridin-2-amine |
| InChI | InChI=1S/C14H15ClN2O2/c15-12-8-13(14(16)17-9-12)19-7-6-18-10-11-4-2-1-3-5-11/h1-5,8-9H,6-7,10H2,(H2,16,17) |
| InChI Key | BBIWEXNATQTTCV-UHFFFAOYSA-N |
| MDL Number | MFCD28122675 |
| Molecular Formula | C14H15ClN2O2 |
| Molecular Weight | 278.7341 |
| SMILES | Clc1cnc(c(c1)OCCOCc1ccccc1)N |
| Synonyms | 1820650-93-8,
3-(2-(Benzyloxy)ethoxy)-5-chloropyridin-2-amine,
3-[2-(BENZYLOXY)ETHOXY]-5-CHLOROPYRIDIN-2-AMINE,
ZINC216701644,
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| Complexity | 250 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 278.082g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 278.736g/mol |
| Monoisotopic Mass | 278.082g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 57.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
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