Basic information
- CAS
52625-27-1- Standard SMILES
O=C(Nc1ccc(Cl)cc1)N1CCOCC1- InChIKey
CJZZDRMAUJOWAD-UHFFFAOYSA-N- Molecular formula
- C11H13ClN2O2
- Average molar mass
- 240.68 g/mol
- Monoisotopic mass
- 240.0665554
Names & identifiers
- Preferred name
- N-(4-chlorophenyl)morpholine-4-carboxamide
- IUPAC
- N-(4-chlorophenyl)morpholine-4-carboxamide
- English name
- Morpholine-4-carboxylic acid (4-chloro-phenyl)-amide
- Molecular formula
- C11H13ClN2O2
- Molecular weight
- 240.69
Names & synonyms
N-(4-chlorophenyl)morpholine-4-carboxamide52625-27-1Morpholine-4-carboxylic acid (4-chloro-phenyl)-amideN-(4-chlorophenyl)-4-morpholinecarboxamideCambridge id 5191768MLS001203339CHEMBL1486933SCHEMBL10594359HMS2843G20STL282662AKOS000621678CCG-108292
Show more names
4-(4-CHLOROPHENYLCARBAMOYL)MORPHOLINE4-Morpholinecarboxamide, N-(4-chlorophenyl)-
SMR000516356N-(4-chlorophenyl)morpholin-4-ylcarboxamideST50113639SR-01000455000SR-01000455000-1Z44590812
Database identifiers
- CAS
52625-27-1- PubChem CID
- 759971
- ChEMBL
CHEMBL1486933- EC Number
- 688-800-1
- Nikkaji
- J3.585.584J
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 236
Experimental & physicochemical properties
Solubility>36.1 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Melting point
- 196 °C · 196 °C
- Boiling point
- 448 · 448.0±45.0 °C(Predicted)
- Density
- 1.343 · 1.343±0.06 g/cm3(Predicted)
- pka
- 12.7 · 12.70±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- 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, 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.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers4 total
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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