2-Methyl-1-propylnaphthalene
Basic information
- CAS
54774-89-9- Standard SMILES
CCCc1c(C)ccc2ccccc12- InChIKey
BTYYGWOCMUPYPQ-UHFFFAOYSA-N- Molecular formula
- C14H16
- Average molar mass
- 184.28 g/mol
- Monoisotopic mass
- 184.12520051
Names & identifiers
- Preferred name
- 2-Methyl-1-propylnaphthalene
- IUPAC
- 2-methyl-1-propylnaphthalene
- English name
- 2-Methyl-1-propylnaphthalene
- Molecular formula
- C14H16
- Molecular weight
- 184.28
Names & synonyms
2-METHYL-1-PROPYLNAPHTHALENE54774-89-9Naphthalene, 2-methyl-1-propyl-Methyl-n-propylnaphthalinSCHEMBL1706021SCHEMBL1706721SCHEMBL21274302-Methyl-1-propylnaphthalene #DTXSID50203241BTYYGWOCMUPYPQ-UHFFFAOYSA-NDB-324028NS00095906
Database identifiers
- CAS
54774-89-9- PubChem CID
- 41172
- DTXSID
DTXSID50203241- Nikkaji
- J127.116D
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 173
Physicochemical properties
- Melting point
- 47.02 °C · 47.02°C (estimate)
- Boiling point
- 288.25 °C · 288.25°C (estimate)
- Density
- 0.9844 · 0.9844 (estimate)
- refractive index
- 1.5855 · 1.5855 (estimate)
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Related reactions
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Compound notes
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