Formamide, N-(2-chlorophenyl)-
Basic information
- CAS
2596-93-2- Standard SMILES
O=CNc1ccccc1Cl- InChIKey
DGRDTMLQUWBPSM-UHFFFAOYSA-N- Molecular formula
- C7H6ClNO
- Average molar mass
- 155.58 g/mol
- Monoisotopic mass
- 155.0137915
Names & identifiers
- Preferred name
- Formamide, N-(2-chlorophenyl)-
- IUPAC
- N-(2-chlorophenyl)formamide
- English name
- N-(2-Chloro-phenyl)-formamide
- Molecular formula
- C7H6ClNO
- Molecular weight
- 155.58
Names & synonyms
2596-93-2Formamide, N-(2-chlorophenyl)-2'-ChloroformanilideFormanilide, 2'-chloro-DTXSID70180626NSC 30093RefChem:141209DTXCID10103117DGRDTMLQUWBPSM-UHFFFAOYSA-NN-(2-Chlorophenyl)formamideN-(2-chlorophenyl)-formamideNSC-30093
Show more names
TIMTEC-BB SBB004025N-(2-chlorophenyl)methanamide(2-Chloroanilino)formaldehydeN-(2-Chloro-phenyl)-formamide
2-ChlorophenylformamideNSC30093Dotinurad Impurity 1452-Chlorophenylformamide #AVF9E68ZP9SCHEMBL227130SCHEMBL227131SCHEMBL10373768
Database identifiers
- CAS
2596-93-2- PubChem CID
- 137653
- DTXSID
DTXSID70180626- UNII
- AVF9E68ZP9
- EC Number
- 621-716-5
- Nikkaji
- J145.254A
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 118
Experimental & physicochemical properties
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Physicochemical properties
- Melting point
- 76 · 76-80 °C(lit.)
- Boiling point
- 316.2 · 316.2±25.0 °C(Predicted)
- Density
- 1.316 · 1.316±0.06 g/cm3(Predicted)
- pka
- 14.07 · 14.07±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS08
- Signal word
- Danger
- Hazard statements
- 302 · H302-H319-H334
- Precautionary statements
- 261 · P261-P305+P351+P338-P342+P311
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-36-42/43
- Safety Statements
- 22 · 22-26-36/37-45
- WGK Germany
- 3 · 3
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P233, P260, P264, P264+P265, P270, P271, P280, P284, P301+P317, P304+P340, P305+P351+P338, P330, P337+P317, P342+P316, P403, 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.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- risk_code
- 22-36-42/43
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS08
- hazard_code
- Xn
- safety_code
- 22-26-36/37-45
- Hazard statements
- H302-H319-H334
- Precautionary statements
- P261-P305+P351+P338-P342+P311
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…