Basic information
- CAS
3678-65-7- Standard SMILES
CCc1cc(Cl)ccn1- InChIKey
OUGWLZBVFAGJBC-UHFFFAOYSA-N- Molecular formula
- C7H8ClN
- Average molar mass
- 141.6 g/mol
- Monoisotopic mass
- 141.034527
Names & identifiers
- Preferred name
- 4-Chloro-2-ethylpyridine
- IUPAC
- 4-chloro-2-ethylpyridine
- English name
- 4-chloro-2-ethylpyridine
- Molecular formula
- C7H8ClN
- Molecular weight
- 141.6
Names & synonyms
4-Chloro-2-ethylpyridine3678-65-7EINECS 222-952-8DTXSID90190242RefChem:98358DTXCID00112733222-952-84-chloro-2-ethyl-pyridine2-ethyl-4-chloropyridineSCHEMBL1507045SCHEMBL1966773SCHEMBL1987438
Show more names
Pyridine, 4-chloro-2-ethyl-
SCHEMBL4927241SCHEMBL17103357AKOS015943336SB53318CS-39833DB-357972NS00030091
Database identifiers
- CAS
3678-65-7- PubChem CID
- 77249
- DTXSID
DTXSID90190242- EC Number
- 222-952-8
- Nikkaji
- J205.590B
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
- 85
Physicochemical properties
- Boiling point
- 76 · 76-78 °C(Press: 18-19 Torr)
- Density
- 1.111 · 1.111±0.06 g/cm3(Predicted)
- pka
- 4.09 · 4.09±0.10(Predicted)
Chemistry & industry
Suppliers5 total
康姆芘法思（上海）生物科技有限公司021-65232103 17602124823 · [email protected]
康姆芘法思（上海）生物科技有限公司021-65232103 17602124823 · [email protected]
上海安米克化学品有限公司微信：18019252918 18019252918 · [email protected]
济南鑫宏泰化学有限公司13000000000 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
Related reactions
1 records
Compound notes
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