Basic information
- Standard SMILES
ClCc1ccnc(Cl)c1- InChIKey
QELZCGMVHLQNSO-UHFFFAOYSA-N- Molecular formula
- C6H5Cl2N
- Average molar mass
- 162.01 g/mol
- Monoisotopic mass
- 160.9799046
Names & identifiers
- Preferred name
- 2-Chloro-4-(chloromethyl)pyridine
- IUPAC
- 2-chloro-4-(chloromethyl)pyridine
- English name
- Pyridine, 2-chloro-4-(chloromethyl)- (9CI)
- Molecular formula
- C6H5Cl2N
- Molecular weight
- 162.02
Names & synonyms
2-chloro-4-(chloromethyl)pyridine101990-73-2DTXSID70456095RefChem:258690DTXCID70406914801-257-92-Chloro-4-chloromethylpyridinePYRIDINE, 2-CHLORO-4-(CHLOROMETHYL)-2-Chloro-4-chloromethyl-pyridineMFCD09991655Pyridine, 2-chloro-4-(chloromethyl)- (9CI)2-chloro-4chloromethylpyridine
Show more names
2-chloro-pyridin-4-ylmethyl chloride2-Chloro-4-(chloromethyl)pyridine 97%2-Chloro-4-(chloroMethyl)pyridine, 97+%Pyridine, 2-chloro-4-(chloromethyl)- (9CI) HCLPyridine, 2-chloro-4-(chloromethyl)- (9CI) ISO 9001:2015 REACH
SCHEMBL1503624QELZCGMVHLQNSO-UHFFFAOYSA-N4-(chloromethyl)-2-chloropyridineBEA990732-chloro-4-(chloro-methyl)pyridineSBB087556AKOS006223868AB55687
Database identifiers
- CAS
101990-73-2- PubChem CID
- 11126573
- DTXSID
DTXSID70456095- EC Number
- 801-257-9
- Nikkaji
- J1.643.125G
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 87
Physicochemical properties
- Melting point
- 123 · 123-125℃
- Boiling point
- 51 °C · 51 °C(Press: 0.9 Torr)
- Density
- 1.324 · 1.324
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 0.13 · 0.13±0.10(Predicted)
- form
- liquid
- color
- Pink
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P271-P280
- HazardClass
- IRRITANT
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety data
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P271-P280
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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Related reactions
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