Basic information
- CAS
2750-22-3- Standard SMILES
COc1ccc(N)cc1C(=O)c1ccccc1.Cl- InChIKey
QKEZZSDESAPJDI-UHFFFAOYSA-N- Molecular formula
- C14H14ClNO2
- Average molar mass
- 263.72 g/mol
- Monoisotopic mass
- 263.0713064
Names & identifiers
- Preferred name
- 3-Benzoyl-4-methoxyaniline hydrochloride
- IUPAC
- (5-amino-2-methoxyphenyl)-phenylmethanone;hydrochloride
Names & synonyms
3-benzoyl-4-methoxyaniline hydrochloride2750-22-3RefChem:497940996-573-8(5-amino-2-methoxyphenyl)-phenylmethanone;hydrochlorideCAA750223-benzoyl-4-methoxyanilinehydrochlorideEN300-344556Z2737901431
Database identifiers
- CAS
2750-22-3- PubChem CID
- 126809123
- EC Number
- 996-573-8
Properties
Computed structural properties
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 261
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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