| CAS Number | 4226-36-2 |
| Catalog Number | AG00CLES |
| Chemical Name | 3-(2-Chloroethyl)pyridine hydrochloride |
| IUPAC Name | 3-(2-chloroethyl)pyridine;hydrochloride |
| InChI | InChI=1S/C7H8ClN.ClH/c8-4-3-7-2-1-5-9-6-7;/h1-2,5-6H,3-4H2;1H |
| InChI Key | AGHZTJNWQBPUGL-UHFFFAOYSA-N |
| MDL Number | MFCD01691966 |
| Molecular Formula | C7H9Cl2N |
| Molecular Weight | 178.0591 |
| SMILES | ClCCC1=CC=CN=C1.[H]Cl |
| Synonyms | 3-(2-Chloroethyl)pyridine hydrochloride,
4226-36-2,
Pyridine, 3-(2-chloroethyl)-, hydrochloride,
AC1L57FV,
SCHEMBL178021,
CTK8I6988,
DTXSID10195092,
AGHZTJNWQBPUGL-UHFFFAOYSA-N,
MFCD01691966,
AKOS026727534,
NE11923,
3-(2-chloroethyl)-Pyridine hydrochloride,
SC-32701,
2-(3-pyridyl)ethyl chloride hydrochloride,
LS-131087,
C7-H8-Cl-N.Cl-H,
CID199465,
3-(2-chloroethyl)pyridine,hydrochloride,
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| Complexity | 75.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.056g/mol |
| Monoisotopic Mass | 177.011g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number