Basic information
- CAS
199458-96-3- Standard SMILES
Cc1ccccc1NC(=O)c1ccc(-c2ccccc2Cl)o1- InChIKey
XTZXHNLQEJTWRQ-UHFFFAOYSA-N- Molecular formula
- C18H14ClNO2
- Average molar mass
- 311.8 g/mol
- Monoisotopic mass
- 311.0713064
Names & identifiers
- Preferred name
- 5-(2-Chlorophenyl)-N-(2-methylphenyl)-2-furamide
- IUPAC
- 5-(2-chlorophenyl)-N-(2-methylphenyl)furan-2-carboxamide
- English name
- 5-(2-chlorophenyl)-N-(2-methylphenyl)furan-2-carboxamide
- Molecular formula
- C18H14ClNO2
- Molecular weight
- 311.76
Names & synonyms
199458-96-35-(2-chlorophenyl)-N-(2-methylphenyl)-2-furamideRefChem:529422661-440-25-(2-chlorophenyl)-N-(2-methylphenyl)furan-2-carboxamide5-(2-Chlorophenyl)-N-(o-tolyl)furan-2-carboxamideSTK518631AKOS001215012CCG-356338ST50439861Z79397815[5-(2-chlorophenyl)(2-furyl)]-N-(2-methylphenyl)carboxamide
Show more names
2-Furancarboxamide, 5-(2-chlorophenyl)-N-(2-methylphenyl)-
Database identifiers
- CAS
199458-96-3- PubChem CID
- 4493564
- EC Number
- 661-440-2
- Nikkaji
- J1.318.532H
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 42.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 389
Physicochemical properties
- Boiling point
- 383.1 · 383.1±42.0 °C(Predicted)
- Density
- 1.274 · 1.274±0.06 g/cm3(Predicted)
- pka
- 12.63 · 12.63±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H413
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, 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. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H413
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
OTAVA-BB[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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