6-Chloromethyl-2-methylpyridinium chloride
Basic information
- CAS
3099-30-7- 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
- English name
- 6-chloromethyl-2-methylpyridinium chloride
- Molecular formula
- C7H9Cl2N
- Molecular weight
- 178.05906
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
EOS-62035-6-methylpyridine hydrochloride6-Chlormethyl-2-methylpyridiniumchlorid6-chloromethy1-2-methylpyridiniumchloridePYRIDINE,2-(CHLOROMETHYL)-6-METHYL-,HYDROCHLORIDE
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
Physicochemical properties
- Melting point
- 146 · 146-153 °C(Solv: acetone (67-64-1))
- storage temp.
- -20 °C · Inert atmosphere,Store in freezer, under -20°C
- form
- powder to crystal
- color
- White to Orange to Green
- InChI
- 1S/C7H8ClN.ClH/c1-6-3-2-4-7(5-8)9-6;/h2-4H,5H2,1H3;1H
- InChIKey
- QFLPSIUFCCCRMI-UHFFFAOYSA-N
- SMILES
- [H]Cl.ClCC1=CC=CC(C)=N1
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314-H290
- Precautionary statements
- 501 · P501-P260-P234-P264-P280-P390-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P406-P405
- WGK Germany
- 3 · WGK 3
- HS Code
- 2933.39 · 2933.39.6190
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
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%)
Safety data
- wgk
- WGK 3
- hs_code
- 2933.39.6190
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H314-H290
- Hazard Classifications
- Acute Tox. 4 Oral
- Precautionary statements
- P501-P260-P234-P264-P280-P390-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P406-P405
Related reactions
19 records
Compound notes
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