Basic information
- Standard SMILES
CCOC(=O)c1cccc(CCl)n1.Cl- InChIKey
MTSYCIFXVKZUQK-UHFFFAOYSA-N- Molecular formula
- C9H11Cl2NO2
- Average molar mass
- 236.09 g/mol
- Monoisotopic mass
- 235.01668395
Names & identifiers
- Preferred name
- Ethyl 6-(chloromethyl)picolinate hydrochloride
- IUPAC
- ethyl 6-(chloromethyl)pyridine-2-carboxylate;hydrochloride
- English name
- Ethyl 6-(chloroMethyl)picolinate hydrochloride
- Molecular formula
- C9H11Cl2NO2
- Molecular weight
- 236.09514
Names & synonyms
Ethyl 6-(chloromethyl)picolinate hydrochloride892664-08-3Ethyl6-(chloromethyl)picolinatehydrochlorideSCHEMBL2959591DTXSID70738388MTSYCIFXVKZUQK-UHFFFAOYSA-Nethyl 6-(chloromethyl)-2-pyridinecarboxylate hydrochlorideethyl 6-(chloromethyl)pyridine-2-carboxylate;hydrochloride6-Chloromethylpyridine-2-carboxylic acid ethyl ester hydrochlorideEthyl 6-(chloromethyl)pyridine-2-carboxylate--hydrogen chloride (1/1)
Database identifiers
- CAS
892664-08-3- PubChem CID
- 68457584
- DTXSID
DTXSID70738388
Properties
Computed structural properties
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 175
Physicochemical properties
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers2 total
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
Related reactions
2 records
Linked notes
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