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52684-34-1

Basic Information
CAS No.: 52684-34-1
Name: 2-Naphthyl acrylate
Article Data: 6
Molecular Structure:
Molecular Structure of 52684-34-1 (2-Naphthyl acrylate)
Formula: C13H10O2
Molecular Weight: 198.221
Synonyms: 2-Naphthyl acrylate;
Density: 1.147 g/cm3
Melting Point: 38-42 °C
Boiling Point: 345.426 °C at 760 mmHg
Flash Point: 143.685 °C
Hazard Symbols: IrritantXi
Risk Codes: 36
Safety: 26
PSA: 26.30000
LogP: 2.93120
Synthetic route
79-10-7

acrylic acid

135-19-3

β-naphthol

52684-34-1

2-naphthyl acrylate

Conditions
ConditionsYield
With magnesium hydroxide; di-tert-butyl dicarbonate; lithium carbonate at 25℃; for 24h; Reagent/catalyst;95%
814-68-6

acryloyl chloride

135-19-3

β-naphthol

52684-34-1

2-naphthyl acrylate

Conditions
ConditionsYield
With triethylamine In dichloromethane at 20℃; Inert atmosphere;82%
With triethylamine In acetone at 20℃; for 0.5h; Inert atmosphere;1.32 g
With triethylamine In acetone at 20℃; for 0.5h; Inert atmosphere;1.32 g
79-10-7

acrylic acid

135-19-3

β-naphthol

A

52684-34-1

2-naphthyl acrylate

B

111709-01-4

β-Naphthyl-β-chlorpropionat

Conditions
ConditionsYield
With phosphorus pentachloride In neat (no solvent) 1.) 110-120 deg C, 1 h, 2.) room temp., 2.5 h then 90 deg C, 3 h;A n/a
B 43%
814-68-6

acryloyl chloride

135-19-3

β-naphthol

A

52684-34-1

2-naphthyl acrylate

B

111709-01-4

β-Naphthyl-β-chlorpropionat

Conditions
ConditionsYield
With aluminium trichloride In neat (no solvent) 1.) 80-90 deg C, 3 h, 2.) 100 deg C, 1 h;A n/a
B 43%
1056904-02-9

N-(4-chlorobenzylidene)-4-methoxybenzenesulfonamide

52684-34-1

2-naphthyl acrylate

1268833-26-6

(R)-naphthalen-2-yl 2-((4-chlorophenyl)(4-methoxyphenylsulfonamido)methyl)acrylate

Conditions
ConditionsYield
With tert-butyl (2-((4-((1R)-7-ethylhexahydro-1H-3,7-methanopyrrolo[2,1-c][1,4]oxazin-1-yl)quinolin-6-yl)amino)-2-oxoethyl)carbamate; β-naphthol In dichloromethane at -30℃; for 48h; Morita-Baylis-Hillman Alkylation; Inert atmosphere; enantioselective reaction;100%
52684-34-1

2-naphthyl acrylate

1241834-17-2

C16H29NO4S2Si

1241833-84-0

C23H33NO4SSi

Conditions
ConditionsYield
With C26H27N3O2; β-naphthol In dichloromethane at 10℃; for 12h; Aza-Morita-Baylis-Hillman reaction; Molecular sieve; Inert atmosphere; optical yield given as %ee; enantioselective reaction;99%
52684-34-1

2-naphthyl acrylate

1241834-07-0

C18H23NO5S2

A

1056904-26-7

C25H27NO5S

B

1241833-79-3

C19H16O4S

Conditions
ConditionsYield
With C26H27N3O2; β-naphthol In dichloromethane at 10℃; for 12h; Aza-Morita-Baylis-Hillman reaction; Molecular sieve; Inert atmosphere; optical yield given as %ee; enantioselective reaction;A 99%
B n/a
52684-34-1

2-naphthyl acrylate

73845-05-3

(E)-N-benzylidenemethanesulfonamide

1268833-10-8

C21H19NO4S

Conditions
ConditionsYield
With (S)-N-(1-(diphenylphosphanyl)-3-methylbutan-2-yl)-4-methylbenzenesulfonamide In tetrahydrofuran at 20℃; for 24h; Aza-Morita-Baylis-Hillman reaction; Inert atmosphere; optical yield given as %ee; enantioselective reaction;99%
1217-89-6

1-benzylisatin

52684-34-1

2-naphthyl acrylate

1263090-11-4

C28H21NO4

Conditions
ConditionsYield
With 4-(3-ethyl-4-oxa-1-azatricyclo[4,4,0,0(3,8)]dec-5-yl)quinolin-6-ol In dichloromethane at 20℃; for 40h; asymmetric Morita-Baylis-Hillman reaction; optical yield given as %ee; enantioselective reaction;97%
52684-34-1

2-naphthyl acrylate

N-[1-(4-Fluoro-phenyl)-meth-(E)-ylidene]-4-methoxy-benzenesulfonamide

1268833-24-4

(R)-naphthalen-2-yl 2-((4-fluorophenyl)(4-methoxyphenylsulfonamido)methyl)acrylate

Conditions
ConditionsYield
With N-((2S,3R)-3-((2,3-dimethylbutan-2-yl)dimethylsilyloxy)-1-(diphenylphosphino)butan-2-yl)-4-methylbenzenesulfonamide In tetrahydrofuran at -30℃; for 48h; Aza-Morita-Baylis-Hillman reaction; Inert atmosphere; optical yield given as %ee; enantioselective reaction;96%
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Specification

The 2-Propenoic acid, 2-naphthalenyl ester, with the CAS registry number 52684-34-1, is also known as 2-Naphthyl acrylate. It belongs to the product categories of Monomer; C12 to C63 Photonic and Optical Materials; Carbonyl Compounds; Esters; Photoluminescent Materials > Fluorescent Monomers. This chemical's molecular formula is C13H10O2 and molecular weight is 198.22. What's more, its IUPAC name is called 2-Naphthyl acrylate.

Physical properties about 2-Propenoic acid, 2-naphthalenyl ester are: (1)ACD/LogP: 3.171; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.17; (4)ACD/LogD (pH 7.4): 3.17; (5)ACD/BCF (pH 5.5): 151.26; (6)ACD/BCF (pH 7.4): 151.26; (7)ACD/KOC (pH 5.5): 1264.33; (8)ACD/KOC (pH 7.4): 1264.33; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.609; (14)Molar Refractivity: 59.795 cm3; (15)Molar Volume: 172.778 cm3; (16)Polarizability: 23.704×10-24cm3; (17)Surface Tension: 42.602 dyne/cm; (18)Density: 1.147 g/cm3; (19)Flash Point: 143.685 °C; (20)Enthalpy of Vaporization: 58.949 kJ/mol; (21)Boiling Point: 345.426 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

When you are dealing with this chemical, you should be very careful. This chemical is inflammation to the skin, eyes and respiratory system or other mucous membranes. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(Oc2ccc1c(cccc1)c2)\C=C
(2) InChI: InChI=1S/C13H10O2/c1-2-13(14)15-12-8-7-10-5-3-4-6-11(10)9-12/h2-9H,1H2
(3) InChIKey: SLVJUZOHXPZVLR-UHFFFAOYSA-N