2-chloro-N-(pyridin-2-ylmethyl)acetamide
Basic information
- CAS
46120-62-1- Standard SMILES
O=C(CCl)NCc1ccccn1- InChIKey
DGFBCFICXACZKT-UHFFFAOYSA-N- Molecular formula
- C8H9ClN2O
- Average molar mass
- 184.62 g/mol
- Monoisotopic mass
- 184.0403406
Names & identifiers
- Preferred name
- 2-chloro-N-(pyridin-2-ylmethyl)acetamide
- IUPAC
- 2-chloro-N-(pyridin-2-ylmethyl)acetamide
- English name
- 2-Chloro-N-(pyridin-2-ylmethyl)acetamide hydrochloride
- Molecular formula
- C8H9ClN2O
- Molecular weight
- 184.62
Names & synonyms
2-chloro-N-(pyridin-2-ylmethyl)acetamide46120-62-12-Chloro-N-pyridin-2-ylmethyl-acetamide2-chloro-N-[(pyridin-2-yl)methyl]acetamideSCHEMBL3841381SCHEMBL30585275DTXSID80963508DGFBCFICXACZKT-UHFFFAOYSA-NMFCD03381856AKOS0002633662-Chloro-N-pyridin-2-ylmethylacetamideNCGC00661773-01
Show more names
Acetamide, 2-chloro-N-(2-pyridinylmethyl)-
VS-09527CS-03272372-CHLORO-N-(2-PYRIDYLMETHYL)ACETAMIDEG81247Chloro-N-[(pyridin-2-yl)methyl]ethanimidic acid2-Chloro-N-[(pyridin-2-yl)methyl]ethanimidic acid
Database identifiers
- CAS
46120-62-1- PubChem CID
- 2497484
- DTXSID
DTXSID80963508
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 152
Physicochemical properties
- Boiling point
- 385.1 · 385.1±32.0 °C(Predicted)
- Density
- 1.236 · 1.236±0.06 g/cm3(Predicted)
- pka
- 12.81 · 12.81±0.46(Predicted)
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 302 · H302-H314
- Precautionary statements
- 264 · P264-P270-P271-P280-P303+P361+P353-P304+P340-P305+P351+P338-P310-P330-P331-P363-P403+P233-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- Hazard statements
- H302-H314
- Precautionary statements
- P264-P270-P271-P280-P303+P361+P353-P304+P340-P305+P351+P338-P310-P330-P331-P363-P403+P233-P501
Related reactions
3 records
Compound notes
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