Basic information
- CAS
17223-66-4- Standard SMILES
CC(=O)CC(=O)Nc1ccc(Cl)cc1Cl- InChIKey
YTKNYOWCICFXOW-UHFFFAOYSA-N- Molecular formula
- C10H9Cl2NO2
- Average molar mass
- 246.09 g/mol
- Monoisotopic mass
- 245.0010339
Names & identifiers
- Preferred name
- 2',4'-Dichloroacetoacetanilide
- IUPAC
- N-(2,4-dichlorophenyl)-3-oxobutanamide
- English name
- 2,4-Dichloroacetoacetanilide
- Molecular formula
- C10H9Cl2NO2
- Molecular weight
- 246.09
Names & synonyms
2',4'-DichloroacetoacetanilideDTXSID50169217EINECS 241-262-8NSC 132855RefChem:439413DTXCID2091708241-262-8N-(2,4-dichlorophenyl)-3-oxobutanamide17223-66-4MFCD00085383NSC-132855NSC132855
Show more names
CHEMBRDG-BB 60882682,4-DICHLOROACETOACETANILID2,4-Dichloroacetoacetanilide2,4-Dichloro-3-oxo-N-phenylbutanaMideN-(2,4-Dichlorophenyl)-3-oxobutyramideButanamide, N-(2,4-dichlorophenyl)-3-oxo-N-(2,4-dichlorophenyl)-3-oxobutanamide(SALTDATA: FREE)
CBMicro_010211QVC5PJ7K78SCHEMBL9180503SCHEMBL31590796YTKNYOWCICFXOW-UHFFFAOYSA-NSMSF0013731STK833033ACETOACETO-2,4-DICHLOROANILIDE
Database identifiers
- CAS
17223-66-4- PubChem CID
- 87007
- DTXSID
DTXSID50169217- UNII
- QVC5PJ7K78
- EC Number
- 241-262-8
- Nikkaji
- J318.181B
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 258
Physicochemical properties
- Boiling point
- 416.2 · 416.2±45.0 °C(Predicted)
- Density
- 1.393 · 1.393±0.06 g/cm3(Predicted)
- pka
- 10.65 · 10.65±0.46(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
- HS Code
- 2924297099 · 2924297099
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2924297099
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers5 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
Alchem Pharmtech,Inc.8485655694 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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