2-chloro-N-(4-methoxyphenyl)propanamide
Basic information
- CAS
21262-10-2- Standard SMILES
COc1ccc(NC(=O)C(C)Cl)cc1- InChIKey
DGAWNIKUBVWNHS-UHFFFAOYSA-N- Molecular formula
- C10H12ClNO2
- Average molar mass
- 213.66 g/mol
- Monoisotopic mass
- 213.0556563
Names & identifiers
- Preferred name
- 2-chloro-N-(4-methoxyphenyl)propanamide
- IUPAC
- 2-chloro-N-(4-methoxyphenyl)propanamide
- English name
- 2-Chloro-N-(4-methoxyphenyl)propanamide
- Molecular formula
- C10H12ClNO2
- Molecular weight
- 213.66
Names & synonyms
2-chloro-N-(4-methoxyphenyl)propanamideRefChem:470196966-083-9MFCD05666377Propanamide, N-(4-methoxyphenyl)-2-chloro-DGAWNIKUBVWNHS-UHFFFAOYSA-NALBB-002363BBL037304SBB046853STK501979AKOS000263722AKOS016345354
Show more names
AURORA KA-4807Propanamide, 2-chloro-N-(4-methoxyphenyl)-
FC114008VS-14055CS-0215321ST50945639EN300-23324H22050N-(4-Methoxyphenyl)-2-chloropropanamide, 95%F341380
Database identifiers
- CAS
21262-10-2- PubChem CID
- 532269
- EC Number
- 966-083-9
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 191
Physicochemical properties
- Melting point
- 106 · 106-107.5 °C
- Boiling point
- 379.2 · 379.2±27.0 °C(Predicted)
- Density
- 1.222 · 1.222±0.06 g/cm3(Predicted)
- pka
- 12.55 · 12.55±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
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]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…