1-Tetralone
Properties
- Molecular formula
- C10H10O
- Molar mass
- 146.19 g/mol
- Exact mass
- 146.0732 Da
- Density
- 1.0988 g/mL (at 16 °C)
- Melting point
- 8 °C
- Boiling point
- 255–257 °C
- logP
- 2.21Crippen estimate
- Polar surface area
- 17.1 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 0
Identifiers
CAS number
529-34-0SMILES
O=C1CCCc2ccccc21InChIKey
XHLHPRDBBAGVEG-UHFFFAOYSA-NInChI
InChI=1S/C10H10O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6H,3,5,7H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
12 names
- 1(2H)-Naphthalenone, 3,4-dihydro-
- 3,4-Dihydro-1(2H)-naphthalenone
- α-Tetralone
- 1,2,3,4-Tetrahydronaphthalen-1-one
- 3,4-Dihydro-2H-naphthalen-1-one
- 1-Oxotetralin
- 1,2,3,4-Tetrahydro-1-oxonaphthalene
- 1-Oxo-1,2,3,4-tetrahydronaphthalene
- NSC 5171
- 3,4-Dihydronaphthalen-1(2H)-one
- Benzocyclohexan-1-one
- 3,4-Dihydronaphthalen-1-one
Reactions
Work with 1-Tetralone
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
Benzosuberone826-73-388 % similar
1-Indanone83-33-077 % similar
7-Methyl-1-tetralone22009-37-656 % similar
3,4-Dihydro-7-hydroxy-1(2H)-naphthalenone22009-38-756 % similar
6-Chloro-1-tetralone26673-31-456 % similar
7-Chloro-3,4-dihydro-1(2H)-naphthalenone26673-32-556 % similar
3,4-Dihydro-6-hydroxy-1(2H)-naphthalenone3470-50-656 % similar
1,2,3,4-Tetrahydro-benzo(b)azepin-5-one1127-74-855 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds