Basic information
- Standard SMILES
Cc1cc(Cl)ccc1NC=O- InChIKey
JOGQXVYBVVOYGI-UHFFFAOYSA-N- Molecular formula
- C8H8ClNO
- Average molar mass
- 169.61 g/mol
- Monoisotopic mass
- 169.0294416
Names & identifiers
- Preferred name
- N-(4-Chloro-2-methylphenyl)formamide
- IUPAC
- N-(4-chloro-2-methylphenyl)formamide
- English name
- 4'-chloro-2-formotoluidide
- Molecular formula
- C8H8ClNO
- Molecular weight
- 169.61
Names & synonyms
Show more names
Database identifiers
- CAS
21787-81-5- PubChem CID
- 30815
- DTXSID
DTXSID2073431- EC Number
- 683-586-6
- Nikkaji
- J69.667F
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 140
Physicochemical properties
- Boiling point
- 306.5 °C · 306.5°C (rough estimate)
- Density
- 1.1885 · 1.1885 (rough estimate)
- refractive index
- 1.543 · 1.5430 (estimate)
- EPA Substance Registry System
- Formamide, N-(4-chloro-2-methylphenyl)- (21787-81-5)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H317-H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P270-P301+P312-P330-P501
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P261, P264, P264+P265, P270, P272, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H317-H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers1 total
Related reactions
Linked notes
Loading…