| CAS Number | 1221726-09-5 |
| Catalog Number | AG01A7KA |
| Chemical Name | 3-[2-(chloromethyl)phenoxy]pyridine hydrochloride |
| IUPAC Name | 3-[2-(chloromethyl)phenoxy]pyridine;hydrochloride |
| InChI | InChI=1S/C12H10ClNO.ClH/c13-8-10-4-1-2-6-12(10)15-11-5-3-7-14-9-11;/h1-7,9H,8H2;1H |
| InChI Key | SJCJXSGYCIEPRE-UHFFFAOYSA-N |
| MDL Number | MFCD14705713 |
| Molecular Formula | C12H11Cl2NO |
| Molecular Weight | 256.1278 |
| SMILES | Cl.ClCC1=C(OC2=CN=CC=C2)C=CC=C1 |
| Synonyms | 3-[2-(chloromethyl)phenoxy]pyridine hydrochloride,
1221726-09-5,
AC1Q3BGM,
CTK6H6655,
NE37944,
EN300-58993,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 255.022g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.126g/mol |
| Monoisotopic Mass | 255.022g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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