3-(2,5-dimethoxyphenyl)-N-(tetrahydro-2-furanylmethyl)acrylamide
Basic information
- CAS
301681-89-0- Standard SMILES
COc1ccc(OC)c(/C=C/C(=O)NCC2CCCO2)c1- InChIKey
UEESXKNBZADVGW-VMPITWQZSA-N- Molecular formula
- C16H21NO4
- Average molar mass
- 291.34 g/mol
- Monoisotopic mass
- 291.14705815
Names & identifiers
- Preferred name
- 3-(2,5-dimethoxyphenyl)-N-(tetrahydro-2-furanylmethyl)acrylamide
- IUPAC
- (E)-3-(2,5-dimethoxyphenyl)-N-(oxolan-2-ylmethyl)prop-2-enamide
- English name
- 3-(2,5-dimethoxyphenyl)-N-(tetrahydro-2-furanylmethyl)acrylamide
- Molecular formula
- C16H21NO4
- Molecular weight
- 291.34
Names & synonyms
301681-89-0(E)-3-(2,5-dimethoxyphenyl)-N-(oxolan-2-ylmethyl)prop-2-enamide3-(2,5-dimethoxyphenyl)-N-(tetrahydro-2-furanylmethyl)acrylamide(E)-3-(2,5-dimethoxyphenyl)-N-((tetrahydrofuran-2-yl)methyl)acrylamideSTL331086AKOS001609242AKOS016311997ST053624BIM-0031987.P001AP-906/11787547SR-01000415984SR-01000415984-1
Show more names
2-Propenamide, 3-(2,5-dimethoxyphenyl)-N-[(tetrahydro-2-furanyl)methyl]-
F0849-2423(2E)-3-(2,5-dimethoxyphenyl)-N-(oxolan-2-ylmethyl)prop-2-enamide(2E)-3-(2,5-dimethoxyphenyl)-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Database identifiers
- CAS
301681-89-0- PubChem CID
- 5350201
- EC Number
- 144-700-5
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 358
Physicochemical properties
- Boiling point
- 521.3 · 521.3±50.0 °C(Predicted)
- Density
- 1.135 · 1.135±0.06 g/cm3(Predicted)
- pka
- 14.46 · 14.46±0.46(Predicted)
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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (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 CategoriesEye Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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