Basic information
- Standard SMILES
Cc1cccc(CCl)n1.Cl- InChIKey
QFLPSIUFCCCRMI-UHFFFAOYSA-N- Molecular formula
- C7H9Cl2N
- Average molar mass
- 178.06 g/mol
- Monoisotopic mass
- 177.01120465
Names & identifiers
- Preferred name
- 6-Chloromethyl-2-methylpyridinium chloride
- IUPAC
- 2-(chloromethyl)-6-methylpyridine;hydrochloride
Names & synonyms
6-Chloromethyl-2-methylpyridinium chlorideRefChem:541943221-451-13099-30-72-(Chloromethyl)-6-methylpyridine hydrochlorideMFCD01691969Pyridine, 2-(chloromethyl)-6-methyl-, hydrochloridePyridine, 2-(chloromethyl)-6-methyl-, hydrochloride (1:1)2-(Chloromethyl)-6-methylpyridine, HCl, tech grade2-(chloromethyl)-6-methylpyridine;hydrochlorideNSC-665142-Methyl-6-chloromethylpyridine hydrochloride
Show more names
NSC 66514EINECS 221-451-12-(chloromethyl)-6-methylpyridinium chlorideFG5YQ7W2YR2-(CHLOROMETHYL)-6-METHYLPYRIDINE HCL2-(Chloromethyl)-6-methylpyridinehydrochloride2-(chloromethyl)-6-methyl-pyridine hydrochloride2-(chloromethyl)-6-methylpyridine monohydrochloride
Database identifiers
- CAS
3099-30-7- PubChem CID
- 76545
- DTXSID
DTXSID60184976- UNII
- FG5YQ7W2YR
- EC Number
- 221-451-1
Properties
Computed structural properties
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 85
Safety & regulation
GHS classification
GHS Classification
Danger
H290 (50%): May be corrosive to metals [Warning Corrosive to Metals]
P234, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P390, P405, P406, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesMet. Corr. 1 (50%)
Related reactions
19 records
Linked notes
Loading…