Basic information
- Standard SMILES
O=C(Cl)c1ncccc1Cl- InChIKey
ZAFLZRNJFHWOQQ-UHFFFAOYSA-N- Molecular formula
- C6H3Cl2NO
- Average molar mass
- 176 g/mol
- Monoisotopic mass
- 174.95916908
Names & identifiers
- Preferred name
- 3-Chloropyridine-2-carbonyl chloride
- IUPAC
- 3-chloropyridine-2-carbonyl chloride
- English name
- 2-Pyridinecarbonyl chloride, 3-chloro- (9CI)
- Molecular formula
- C6H3Cl2NO
- Molecular weight
- 176
Names & synonyms
3-chloropyridine-2-carbonyl chloride128073-02-93-Chloropicolinoyl chloride2-Pyridinecarbonyl chloride, 3-chloro- (9CI)3-chloro-pyridine-2-carbonyl chlorideMFCD131739462-PYRIDINECARBONYL CHLORIDE, 3-CHLORO-SCHEMBL3412671DTXSID60664647ZAFLZRNJFHWOQQ-UHFFFAOYSA-N3-Chloro-2-pyridinecarbonyl chlorideDB-331254
Show more names
F521946
Database identifiers
- CAS
128073-02-9- PubChem CID
- 45081497
- DTXSID
DTXSID60664647
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 30 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 140
Physicochemical properties
- Boiling point
- 230 · 230.0±20.0 °C(Predicted)
- Density
- 1.454 · 1.454±0.06 g/cm3(Predicted)
- pka
- -2.1 · -2.10±0.10(Predicted)
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety data
- hs_code
- 2933399990
Chemistry & industry
Suppliers5 total
安徽合诺生物科技有限公司0555-2761852
苏州诺行贸易有限公司0512-65816829 18662214788 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
上海宏驹医药科技有限公司18001895509 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
2 records
Linked notes
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