Basic information
- CAS
379254-97-4- Standard SMILES
CC(Cl)C(=O)Nc1cc(Cl)c(Cl)cc1Cl- InChIKey
UWAQSZNPRHXKKT-UHFFFAOYSA-N- Molecular formula
- C9H7Cl4NO
- Average molar mass
- 287 g/mol
- Monoisotopic mass
- 284.928175
Names & identifiers
- Preferred name
- 2-chloro-N-(2,4,5-trichlorophenyl)propanamide
- IUPAC
- 2-chloro-N-(2,4,5-trichlorophenyl)propanamide
- English name
- 2-Chloro-N-(2,4,5-trichlorophenyl)propanamide
- Molecular formula
- C9H7Cl4NO
- Molecular weight
- 286.97
Names & synonyms
2-chloro-N-(2,4,5-trichlorophenyl)propanamide379254-97-4MFCD03147317DTXSID901250376ALBB-002382BBL037303STK501978AKOS005171057VS-14054CS-0276117EN300-01786H22068
Show more names
T0511-4796Propanamide, 2-chloro-N-(2,4,5-trichlorophenyl)-
Z56862367
Database identifiers
- CAS
379254-97-4- PubChem CID
- 4452006
- DTXSID
DTXSID901250376
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 238
Physicochemical properties
- Boiling point
- 406.6 · 406.6±45.0 °C(Predicted)
- Density
- 1.537 · 1.537±0.06 g/cm3(Predicted)
- pka
- 10.67 · 10.67±0.70(Predicted)
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
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
- hazard_code
- Xi
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers3 total
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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