N-(4-Methoxybenzyl)-3-methyl-1-benzofuran-2-carboxamide
Basic information
- CAS
617695-08-6- Standard SMILES
COc1ccc(CNC(=O)c2oc3ccccc3c2C)cc1- InChIKey
RRJQQNBDEPFCFR-UHFFFAOYSA-N- Molecular formula
- C18H17NO3
- Average molar mass
- 295.3 g/mol
- Monoisotopic mass
- 295.1208434
Names & identifiers
- Preferred name
- N-(4-Methoxybenzyl)-3-methyl-1-benzofuran-2-carboxamide
- IUPAC
- N-[(4-methoxyphenyl)methyl]-3-methyl-1-benzofuran-2-carboxamide
Names & synonyms
617695-08-6N-(4-methoxybenzyl)-3-methyl-1-benzofuran-2-carboxamideRefChem:827741644-283-4N-(4-Methoxybenzyl)-3-methylbenzofuran-2-carboxamideN-[(4-methoxyphenyl)methyl]-3-methyl-1-benzofuran-2-carboxamideTimTec1_007494Oprea1_603794HMS1555E14HTS13795STK880823AKOS000526714
Show more names
IDI1_033148EU-0049741ST50031490Z30869789
Database identifiers
- CAS
617695-08-6- PubChem CID
- 756533
- EC Number
- 644-283-4
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 51.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 379
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
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, 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.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
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Related reactions
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Compound notes
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