Basic information
- CAS
3004-73-7- Standard SMILES
O=C(Nc1cccc(Cl)c1)C(Cl)(Cl)Cl- InChIKey
ZCNFWVGKVHRKCD-UHFFFAOYSA-N- Molecular formula
- C8H5Cl4NO
- Average molar mass
- 272.9 g/mol
- Monoisotopic mass
- 270.912525
Names & identifiers
- Preferred name
- Acetanilide, 2,2,2,3'-tetrachloro-
- IUPAC
- 2,2,2-trichloro-N-(3-chlorophenyl)acetamide
- English name
- AcetaMide, 2,2,2-trichloro-N-(3-chlorophenyl)-
- Molecular formula
- C8H5Cl4NO
- Molecular weight
- 272.94
Names & synonyms
Acetanilide, 2,2,2,3'-tetrachloro-3004-73-7DTXSID10184103RefChem:108873DTXCID801065942,2,2,3'-Tetrachloroacetanilide2,2,2-trichloro-N-(3-chlorophenyl)acetamideAcetamide, N-(3-chlorophenyl)-2,2,2-trichloro-Acetamide, 2,2,2-trichloro-N-(3-chlorophenyl)-ZCNFWVGKVHRKCD-UHFFFAOYSA-NN-(3-chlorophenyl)-trichloroacetamideAKOS003108861
Show more names
Alpha,alpha,alpha,m-tetrachloroacetanilide
Database identifiers
- CAS
3004-73-7- PubChem CID
- 520463
- DTXSID
DTXSID10184103- EC Number
- 665-374-5
- Nikkaji
- J3.309.681J
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 216
Experimental & physicochemical properties
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Physicochemical properties
- Melting point
- 100 °C · 100 °C
- Boiling point
- 353.8 · 353.8±42.0 °C(Predicted)
- Density
- 1.618 · 1.618±0.06 g/cm3(Predicted)
- pka
- 9.88 · 9.88±0.70(Predicted)
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501
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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, 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. 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H301
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…