CAS No.2162-98-3,1,10-Dichlorodecane Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	2162-98-3
Name:	1,10-Dichlorodecane
Article Data:	21

Formula:	C₁₀H₂₀Cl₂
Molecular Weight:	211.175
Synonyms:	NSC 9484;
EINECS:	218-489-6
Density:	0.976 g/cm³
Melting Point:	15.6 °C
Boiling Point:	284.3 °C at 760 mmHg
Flash Point:	108.4 °C
Appearance:	colourless liquid or white solid
Hazard Symbols:	Xi,N
Risk Codes:	38-36/37/38-50/53
Safety:	37/39-26-61-60
Transport Information:	UN 3082
PSA:	0.00000
LogP:	4.58480

Synthetic route

: 56757-75-6
1,10-decamethylene glycol dichloroformate

: 2162-98-3
1,10-dichlorodecane

Conditions

Conditions	Yield
With N,N-dimethyl-formamide at 130 - 140℃;	97%
With hexabutylguanidinium chloride at 120℃; for 4h;	97%

: 112-47-0
1,10-Decanediol

: 2162-98-3
1,10-dichlorodecane

Conditions

Conditions	Yield
With pyridine; thionyl chloride for 1h; Heating;	83%
With thionyl chloride
With pyridine; thionyl chloride
With thionyl chloride
Multi-step reaction with 2 steps 1: cooling 2: 97 percent / hexabutylguanidinium chloride / 4 h / 120 °C View Scheme

: (5-chloropentyl)zinc bromide

: 2162-98-3
1,10-dichlorodecane

Conditions

Conditions	Yield
With Desyl chloride; dichloro[2,2'-bis(diphenylphosphino)-1,1'-binaphthyl]palladium(II) In tetrahydrofuran at 20℃;	72%

: 111-20-6
1,10-decanedioic acid

: 2162-98-3
1,10-dichlorodecane

Conditions

Conditions	Yield
With gallium(III) trichloride; Hexamethyldisiloxane; copper dichloride In 1,2-dichloro-ethane at 60℃; for 5h; Sealed tube; Inert atmosphere;	71%

: 54512-75-3
1-bromo-5-chloropentane

: 2162-98-3
1,10-dichlorodecane

Conditions

Conditions	Yield
With dilithium trichlorocuprate; magnesium In tetrahydrofuran; diethyl ether for 0.416667h; Ambient temperature;	53%
Multi-step reaction with 2 steps 1: (i) Na, liq. NH3, Fe(NO3)3, (ii) /BRN= 1732341/ 2: H2 / Raney-Ni View Scheme
Multi-step reaction with 2 steps 1: liquid ammonia 2: H2 / Raney-Ni View Scheme
With pyridine; manganese; trifluoroacetic acid; cobalt(II) bromide In acetonitrile at 50℃; Reagent/catalyst;	80 %Chromat.

: 4224-62-8
6-chlorohexanoic acid

: 2162-98-3
1,10-dichlorodecane

Conditions

Conditions	Yield
With methanol; sodium Electrolysis;
With sodium In methanol (electrolysis);

: 90943-97-8
1,5,5,6,6,10-hexachloro-decane

: 2162-98-3
1,10-dichlorodecane

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: zinc; ethanol 2: palladium/barium sulfate; methanol. ammonia / Hydrogenation View Scheme
With ammonia; platinum Hydrogenation;

: 63616-36-4
1,5,6,10-tetrachloro-dec-5-ene

: 2162-98-3
1,10-dichlorodecane

Conditions

Conditions	Yield
With Pd-BaSO4; ammonia Hydrogenation;

: 60274-61-5
1,10-dichloro-dec-4-yne

: 2162-98-3
1,10-dichlorodecane

Conditions

Conditions	Yield
With hydrogen; nickel

: 1129-89-1
cis-cyclododecene

: 2162-98-3
1,10-dichlorodecane

Conditions

Conditions	Yield
With oxygen; ozone 1.) ethanol, r.t.; 2.) ethanol, reflux; Yield given. Multistep reaction;

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Specification

The CAS register number of 1,10-Dichlorodecane is 2162-98-3. It also can be called as Decane, 1,10-dichloro- and the IUPAC name about this chemical is 1,10-dichlorodecane. The molecular formula about this chemical is C₁₀H₂₀Cl₂and the molecular weight is 211.17. It belongs to the following product categories which include Building blocks; Alpha,omega-Dichloroalkanes; Alpha,omega-Bifunctional Alkanes; Monofunctional & Alpha,omega-Bifunctional Alkanes; Alkyl; Halogenated Hydrocarbons; Organic Building Blocks and so on. This chemical can be obtained by thionyl chloride chlorination of Sebacic alcohol.

Physical properties about 1,10-Dichlorodecane are: (1)ACD/LogP: 5.43; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.43; (4)ACD/LogD (pH 7.4): 5.43; (5)ACD/BCF (pH 5.5): 7935.91; (6)ACD/BCF (pH 7.4): 7935.91; (7)ACD/KOC (pH 5.5): 21523.95; (8)ACD/KOC (pH 7.4): 21523.95; (9)#Freely Rotating Bonds: 9; (10)Index of Refraction: 1.449; (11)Molar Refractivity: 58.07 cm³; (12)Molar Volume: 216.3 cm³; (13)Polarizability: 23.02x10^-24cm³; (14)Surface Tension: 30.1 dyne/cm; (15)Enthalpy of Vaporization: 50.23 kJ/mol; (16)Boiling Point: 284.3 °C at 760 mmHg; (17)Vapour Pressure: 0.00515 mmHg at 25°C.

Preparation: this chemical can be prepared by 1,10-Bis-chlorformyloxy-decan. This reaction will need reagent DMF. The reaction temperature is 130 - 140 ℃. The yield is about 97%.

Uses of 1,10-Dichlorodecane: it can be used to produce 1-chloro-10-phenoxydecane with phenol at heating. This reaction will need reagent tetrabutylammonium hydrogen sulfate, 3 M aq. NaOH with reaction time of 16 hours. The yield is about 69%.

When you are using this chemical, please be cautious about it as the following:
This chemical is very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. It is irritating to eyes, respiratory system and skin. This material and its container must be disposed of as hazardous waste. If you want to use it, please avoid release to the environment and refer to special instructions / safety data sheets. When you are using it, wear suitable gloves and eye/face protection. After contact with skin, please wash immediately with plenty of soap-suds. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: ClCCCCCCCCCCCl
(2)InChI: InChI=1/C10H20Cl2/c11-9-7-5-3-1-2-4-6-8-10-12/h1-10H2
(3)InChIKey: RBBNTRDPSVZESY-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C10H20Cl2/c11-9-7-5-3-1-2-4-6-8-10-12/h1-10H2
(5)Std. InChIKey: RBBNTRDPSVZESY-UHFFFAOYSA-N