Basic information
- CAS
887407-57-0- Standard SMILES
CCC(=O)NC1CCc2ccc(OC)cc2C1O- InChIKey
AGSZGRLOKYZJMA-UHFFFAOYSA-N- Molecular formula
- C14H19NO3
- Average molar mass
- 249.3 g/mol
- Monoisotopic mass
- 249.13649347
Names & identifiers
- Preferred name
- N-[(1,2,3,4-Tetrahydro-1-hydroxy-7-methoxy-2-naphthalenyl]propanamide
- IUPAC
- N-(1-hydroxy-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamide
- English name
- N-[1,2,3,4-TETRAHYDRO-1-HYDROXY-7-METHOXY-2-NAPHTHALENYL]PROPANAMIDE
- Molecular formula
- C14H19NO3
- Molecular weight
- 249.31
Names & synonyms
887407-57-0N-[(1,2,3,4-Tetrahydro-1-hydroxy-7-methoxy-2-naphthalenyl]propanamideN-(1-hydroxy-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)propanamideSCHEMBL7272279DTXSID701158318N-(1,2,3,4-Tetrahydro-1-hydroxy-7-methoxy-2-naphthalenyl)propanamideAKOS030255316N-[1,2,3,4-TETRAHYDRO-1-HYDROXY-7-METHOXY-2-NAPHTHALENYL]PROPANAMIDEPropanamide, N-(1,2,3,4-tetrahydro-1-hydroxy-7-methoxy-2-naphthalenyl)-
Database identifiers
- CAS
887407-57-0- PubChem CID
- 4450331
- DTXSID
DTXSID701158318
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 295
Physicochemical properties
- Melting point
- 131 · 131-134°C
- Boiling point
- 486.1 · 486.1±45.0 °C(Predicted)
- Density
- 1.17 · 1.17±0.1 g/cm3(Predicted)
- solubility
- Acetone, Dichloromethane, Methanol
- form
- Powder
- pka
- 13.86 · 13.86±0.40(Predicted)
- color
- Off-White
- CAS DataBase Reference
- 887407 · 887407-57-0
Chemistry & industry
Applications
UsesN-[(1,2,3,4-Tetrahydro-1-hydroxy-7-methoxy-2-naphthalenyl]propanamide (cas# 887407-57-0) is a compound useful in organic synthesis.
Suppliers4 total
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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