2-Ethoxy-7-methylnaphthalene
Basic information
- CAS
1134-45-8- Standard SMILES
CCOc1ccc2ccc(C)cc2c1- InChIKey
KSQURRKEYQVXHW-UHFFFAOYSA-N- Molecular formula
- C13H14O
- Average molar mass
- 186.25 g/mol
Names & identifiers
- Preferred name
- 2-Ethoxy-7-methylnaphthalene
- IUPAC
- 2-ethoxy-7-methylnaphthalene
- English name
- Naphthalene, 2-ethoxy-7-methyl- (7CI,8CI,9CI)
- Molecular formula
- C13H14O
- Molecular weight
- 186.25
Names & synonyms
2-ethoxy-7-methylnaphthalene1134-45-8SCHEMBL2623676NAPHTHALENE, 2-ETHOXY-7-METHYL-DB-288139Naphthalene, 2-ethoxy-7-methyl- (7CI,8CI,9CI)
Database identifiers
- CAS
1134-45-8
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 178
Physicochemical properties
- Melting point
- 70 · 70-72 °C
- Boiling point
- 303.4 · 303.4±11.0 °C(Predicted)
- Density
- 1.032 · 1.032±0.06 g/cm3(Predicted)
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Compound notes
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