CAS No.6005-99-8,N-TRIDECANOPHENONE Suppliers

Products Categories

Pharmaceutical (15)
Others (7)
Organic Chemicals (3)

Basic Information

Molecular Structure:
CAS No.:	6005-99-8
Name:	N-TRIDECANOPHENONE
Article Data:	22

Formula:	C₁₉H₃₀O
Molecular Weight:	274.447
Synonyms:	Tridecanophenone(8CI);Dodecyl phenyl ketone;
Density:	0.907g/cm³
Melting Point:	42 °C
Boiling Point:	374.5 °C at 760 mmHg
Flash Point:	142 °C
PSA:	17.07000
LogP:	6.18030

Synthetic route

: (tridec-1-ynyl)benzene

: 6005-99-8
1-phenyltridecan-1-one

Conditions

Conditions	Yield
With iron(III) trifluoromethanesulfonate; trifluorormethanesulfonic acid In tetrahydrofuran at 100℃; for 12h; Schlenk technique; Inert atmosphere;	98%

: C31H52O2

: 6005-99-8
1-phenyltridecan-1-one

Conditions

Conditions	Yield
With iron(III) trifluoromethanesulfonate; trifluorormethanesulfonic acid In tetrahydrofuran at 100℃; for 12h; Reagent/catalyst; Schlenk technique; Inert atmosphere;	96%

: 22986-80-7
2-hydroxy-2-phenyltetradecanoic acid

: 6005-99-8
1-phenyltridecan-1-one

Conditions

Conditions	Yield
With (NMe4)2H2OCH3CN (L = ortho-phenylenebis(N'-methyloxamidate)); oxygen; pivalaldehyde In acetonitrile for 2h; Ambient temperature;	95%
With (NMe4)Co(III)Me2opba2H2OCH3CN; oxygen; pivalaldehyde In acetonitrile for 2h;	95%
With oxygen; pivalaldehyde; Co(III) ortho-phenylene-bis(N'-methyloxamidate) In acetonitrile at 20℃;	95%

: 112-41-4
1-dodecene

3-phenyl-propenal: 3-phenyl-propenal

A: 2345-27-9
tetradecan-2-one

B 1-phenyltridecan-1-one: 1-phenyltridecan-1-one

Conditions

Conditions	Yield
Stage #1: 1-dodecene; 3-phenyl-propenal With 3-methylpyridin-2-ylamine; Wilkinson's catalyst; 4-trifluoromethylbenzoic acid; cyclohexylamine In toluene at 130℃; for 12h; Stage #2: With hydrogenchloride; water In tetrahydrofuran	A 92% B 91%

...Expand

1-dodecene: 1-dodecene

: 100-52-7
benzaldehyde

: 6005-99-8
1-phenyltridecan-1-one

Conditions

Conditions	Yield
With dipotassium peroxodisulfate; methylene blue; potassium carbonate In water at 25℃; for 12h; Irradiation; Green chemistry;	82%

: 112-53-8
1-dodecyl alcohol

: 98-86-2
acetophenone

: 6005-99-8
1-phenyltridecan-1-one

Conditions

Conditions	Yield
With Mg-Al hydrotalcite; chloro[N-[4-(dimethylamino)phenyl]-2-pyridinecarboxamidato](pentamethylcyclopentadienyl)iridium In 5,5-dimethyl-1,3-cyclohexadiene at 160℃; for 8h; Schlenk technique;	80%

: 105-74-8
dilauryl peroxide

: 536-74-3
phenylacetylene

: 6005-99-8
1-phenyltridecan-1-one

Conditions

Conditions	Yield
With iron(III) trifluoromethanesulfonate; trifluorormethanesulfonic acid In tetrahydrofuran at 60 - 100℃; for 13h; Catalytic behavior; Reagent/catalyst; Solvent; Temperature; Schlenk technique; Inert atmosphere; Sealed tube;	78%

: 123-02-4
tridecylbenzene

: 6005-99-8
1-phenyltridecan-1-one

Conditions

Conditions	Yield
With tert.-butylnitrite; N-hydroxyphthalimide In acetonitrile at 80℃; for 24h; Schlenk technique;	70%

: 98-88-4
benzoyl chloride

: 143-15-7
1-dodecylbromide

: 6005-99-8
1-phenyltridecan-1-one

Conditions

Conditions	Yield
With manganese; ethylene dibromide In tetrahydrofuran Product distribution; 1.) 0 deg C to rt, 1 h; 2.) 0 deg C, 20 min; 3.) rt, 30 min; coupling of benzoyl chloride with organomanganese bromides;	68%
With manganese; ethylene dibromide In tetrahydrofuran 1.) 0 deg C to rt, 1 h; 2.) 0 deg C, 20 min; 3.) rt, 30 min;	68%

: 1851-92-9, 132362-82-4
1-hydroxytridecylbenzene

: 6005-99-8
1-phenyltridecan-1-one

Conditions

Conditions	Yield
With thio-xanthene-9-one In dimethyl sulfoxide for 18h; Irradiation; Green chemistry; chemoselective reaction;	66%
at 30℃; for 48h; by Corynebacterium equi IFO 3730;	91 % Chromat.

Total:24 Page 1 of 1 1

Post a RFQ

Cas No.:

Product Name:

Quantity:

Email:

Company name:

Valid Period:

Detailed Requirements:

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

What can I do for you?
Get Best Price

Get Best Price for 6005-99-8

Specification

The 1-Tridecanone,1-phenyl-, with CAS registry number 6005-99-8, has the systematic name of 1-phenyltridecan-1-one. Besides this, it is also called N-Tridecanophenone. And the chemical formula of this chemical is C₁₉H₃₀O. Its molecular weight is 274.44.

Physical properties of 1-Tridecanone,1-phenyl-: (1)ACD/LogP: 7.51; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.51; (4)ACD/LogD (pH 7.4): 7.51; (5)ACD/BCF (pH 5.5): 300219.84; (6)ACD/BCF (pH 7.4): 300219.84; (7)ACD/KOC (pH 5.5): 289951.31; (8)ACD/KOC (pH 7.4): 289951.31; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 12; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.488; (14)Molar Refractivity: 87.24 cm³; (15)Molar Volume: 302.5 cm³; (16)Polarizability: 34.58×10^-24cm³; (17)Surface Tension: 33.9 dyne/cm; (18)Density: 0.907 g/cm³; (19)Flash Point: 142 °C; (20)Enthalpy of Vaporization: 62.19 kJ/mol; (21)Boiling Point: 374.5 °C at 760 mmHg; (22)Vapour Pressure: 8.29E-06 mmHg at 25°C.

Preparation: this chemical can be prepared by 2-hydroxy-2-phenyl-tetradecanoic acid. This reaction will need reagents (NMe₄)Co(III)Me₂opba^.2H₂O^.CH₃CN, pivalaldehyde, O₂ and splvent acetonitrile. The reaction time is 2 hour(s). The yield is about 95%.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccccc1)CCCCCCCCCCCC
(2)InChI: InChI=1/C19H30O/c1-2-3-4-5-6-7-8-9-10-14-17-19(20)18-15-12-11-13-16-18/h11-13,15-16H,2-10,14,17H2,1H3
(3)InChIKey: ZZNDQCACFUJAKJ-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C19H30O/c1-2-3-4-5-6-7-8-9-10-14-17-19(20)18-15-12-11-13-16-18/h11-13,15-16H,2-10,14,17H2,1H3
(5)Std. InChIKey: ZZNDQCACFUJAKJ-UHFFFAOYSA-N