Name: 6-METHYL-1-TETRALONE
SKU: 51015-29-3

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Basic Information

Molecular Structure:
CAS No.:	51015-29-3
Name:	6-METHYL-1-TETRALONE
Article Data:	31

Formula:	C₁₁H₁₂O
Molecular Weight:	160.216
Synonyms:	6-Methyl-1-tetralone;6-Methyl-3,4-dihydronaphthalen-1(2H)-one;6-Methyl-a-tetralone;3,4-dihydro-6-methyl-1(2h)-naphthalenon;6-Methyl-1,2,3,4-tetrahydronaphthalene-1-one;
EINECS:	256-913-1
Density:	1.074 g/cm³
Boiling Point:	284.7 °C at 760 mmHg
Flash Point:	119.7 °C
PSA:	17.07000
LogP:	2.51400

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Specification

The CAS register number of 1(2H)-Naphthalenone,3,4-dihydro-6-methyl- is 51015-29-3. It also can be called as 6-Methyl-1-tetralone and the IUPAC name about this chemical is 6-methyl-3,4-dihydro-2H-naphthalen-1-one. The molecular formula about this chemical is C₁₁H₁₂O and the molecular weight is 160.21. It belongs to the following product category which includes pharmacetical.

Physical properties about 1(2H)-Naphthalenone,3,4-dihydro-6-methyl- are: (1)ACD/LogP: 3.07; (2)ACD/LogD (pH 5.5): 3.07; (3)ACD/LogD (pH 7.4): 3.07; (4)ACD/BCF (pH 5.5): 127.39; (5)ACD/BCF (pH 7.4): 127.39; (6)ACD/KOC (pH 5.5): 1118.06; (7)ACD/KOC (pH 7.4): 1118.06; (8)#H bond acceptors: 1; (9)Polar Surface Area: 17.07 Å²; (10)Index of Refraction: 1.557; (11)Molar Refractivity: 47.99 cm³; (12)Molar Volume: 149 cm³; (13)Polarizability: 19.02x10^-24cm³; (14)Surface Tension: 40.5 dyne/cm; (15)Density: 1.074 g/cm³; (16)Flash Point: 119.7 °C; (17)Enthalpy of Vaporization: 52.36 kJ/mol; (18)Boiling Point: 284.7 °C at 760 mmHg; (19)Vapour Pressure: 0.00294 mmHg at 25 °C.

Preparation: this chemical can be prepared by 4-m-tolyl-butyric acid. This reaction will need reagent of polyphosphoric acid. The reaction needs catalytic agent. The reaction time is 3 hours with reaction temperature of 75 °C.

1(2H)-Naphthalenone,3,4-dihydro-6-methyl- can be prepared by 4-m-tolyl-butyric acid.

Uses of 1(2H)-Naphthalenone,3,4-dihydro-6-methyl-: it can be used to produce 6-methyl-1,2,3,4-tetrahydronaphthalen-1-ol. This reaction will need reagent of NaBH₄ and solvents of ethanol, H₂O. The reaction time is 3 hours with ambient temperature. The yield is about 75%.

1(2H)-Naphthalenone,3,4-dihydro-6-methyl- can be used to produce 6-methyl-1,2,3,4-tetrahydronaphthalen-1-ol.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2c1c(cc(cc1)C)CCC2
(2)Std. InChI: InChI=1S/C11H12O/c1-8-5-6-10-9(7-8)3-2-4-11(10)12/h5-7H,2-4H2,1H3
(3)Std. InChIKey: FPOGGJAFMWYNLI-UHFFFAOYSA-N