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Basic Information
CAS No.: 629-03-8
Name: 1,6-Dibromohexane
Article Data: 36
Molecular Structure:
Molecular Structure of 629-03-8 (1,6-Dibromohexane)
Formula: C6H12Br2
Molecular Weight: 243.969
Synonyms: 1,6-Dibromo-n-hexane;Hexamethylene dibromide;a,w-Dibromohexane;
EINECS: 211-067-2
Density: 1.584 g/cm3
Melting Point: -2-2.5 °C(lit.)
Boiling Point: 244.1 °C at 760 mmHg
Flash Point: 110.8 °C
Solubility: insoluble in water
Appearance: Colorless or pale yellow liquid.
Hazard Symbols: ToxicT, DangerousN, CorrosiveC
Risk Codes: 25-51/53
Safety: 36-45-61
Transport Information: UN 2810 6.1/PG 3
PSA: 0.00000
LogP: 3.33660
Synthetic route
629-11-8

1,6-hexanediol

629-03-8

1 ,6-dibromohexane

Conditions
ConditionsYield
With N-Bromosuccinimide; triphenylphosphine In dichloromethane at -78 - 20℃; for 12h; Darkness; chemoselective reaction;97%
With sulfuric acid; hydrogen bromide
With hydrogen bromide folgendes Erhitzen;
629-11-8

1,6-hexanediol

A

629-03-8

1 ,6-dibromohexane

B

4286-55-9

1-bromo-6-hexanol

Conditions
ConditionsYield
With hydrogen bromide In toluene for 13h; Substitution; Heating;A n/a
B 79%
With hydrogen bromide In toluene for 24h; Heating;A 1%
B 69%
1110667-69-0

O-6-oxohexyl dimethylcarbamothioate

A

629-03-8

1 ,6-dibromohexane

B

57978-00-4

6-bromohexanal

Conditions
ConditionsYield
With 4-(bromomethylene)morpholin-4-ium bromide In dichloromethane at 0℃; for 1h; Inert atmosphere;A 5%
B 75%
1110667-72-5

O-6-hydroxyhexyl dimethylcarbamothioate

A

629-03-8

1 ,6-dibromohexane

B

4286-55-9

1-bromo-6-hexanol

C

1110667-79-2

C7H13BrO2

D

1110667-78-1

6-bromohexyl dimethylthiocarbamate

Conditions
ConditionsYield
With 4-(bromomethylene)morpholin-4-ium bromide In dichloromethane at 0℃; for 0.5h; Inert atmosphere;A 18%
B 13%
C 10%
D 59%
1110667-72-5

O-6-hydroxyhexyl dimethylcarbamothioate

A

629-03-8

1 ,6-dibromohexane

B

4286-55-9

1-bromo-6-hexanol

C

1110667-78-1

6-bromohexyl dimethylthiocarbamate

Conditions
ConditionsYield
With 4-(bromomethylene)morpholin-4-ium bromide In dichloromethane at 0℃; for 24h; Inert atmosphere;A 44%
B 4%
C 50%
32315-10-9

bis(trichloromethyl) carbonate

292638-85-8

acrylic acid methyl ester

349553-73-7

6-azido-hexylamine

629-03-8

1 ,6-dibromohexane

Conditions
ConditionsYield
With N-ethyl-N,N-diisopropylamine In dichloromethane40%
1110667-75-8

O-6-(tetrahydro-2H-pyran-2-yloxy)hexyl dimethylcarbamothioate

A

629-03-8

1 ,6-dibromohexane

B

53963-10-3

2-[(6-bromohexyl)oxy]tetrahydro-2H-pyran

C

4286-55-9

1-bromo-6-hexanol

D

1110667-79-2

C7H13BrO2

Conditions
ConditionsYield
With 4-(bromomethylene)morpholin-4-ium bromide In dichloromethane at 0℃; for 1.5h; Inert atmosphere;A 5%
B 14%
C 27%
D 23%
1110667-76-9

O-6-(tert-butyldimethylsiloxy)hexyl dimethylcarbamothioate

A

629-03-8

1 ,6-dibromohexane

B

4286-55-9

1-bromo-6-hexanol

C

18173-64-3

tert-butyldimethylsilanol

D

129368-70-3

(6-bromohexyloxy)-tert-butyldimethylsilane

Conditions
ConditionsYield
With 4-(bromomethylene)morpholin-4-ium bromide In dichloromethane at 0℃; for 2h; Inert atmosphere;A 10%
B 21%
C 13%
D 26%
592-42-7

1,5-Hexadien

629-03-8

1 ,6-dibromohexane

Conditions
ConditionsYield
With hydrogen bromide at -78℃; Irradiation.mit UV-Licht;
109-64-8

1,3-dibromo-propane

sodium

sodium

A

629-03-8

1 ,6-dibromohexane

B

187737-37-7

propene

C

75-19-4

cyclopropane

Conditions
ConditionsYield
unter Luminescenz;
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  • 1,6-Dibromohexane

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    Product name: 1,6-Dibromohexane CAS No.: 629-03-8 Molecule Formula:C6H12Br2 Molecule Weight:243.97 Purity: 99.0% Package: 200kg/drum Description:Colorless transparent liquid Manufacture Standards:Enterprise Standard TESTING ITEMS

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  • 1,6-Dibromohexane

  • Casno:

    629-03-8

    1,6-Dibromohexane

    Min.Order: 1 Gram

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    1,6-Dibromohexane Chemical Properties Melting point -2-2.5 °C (lit.) Boiling point 243 °C (lit.) density 1.586 g/mL at 25 °C (lit.) vapor pressure <1 hPa (20 °C) refractive index n20/D 1.507(lit.) Fp 110 &de

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    629-03-8

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Chemistry

Molecular Structure of 1,6-Dibromohexane (CAS NO.629-03-8):

IUPAC Name: 1,6-dibromohexane 
Empirical Formula: C6H12Br2
Molecular Weight: 243.9675
H bond acceptors: 0
H bond donors: 0
Freely Rotating Bonds: 5
Polar Surface Area: 0 Å2
Index of Refraction: 1.5
Molar Refractivity: 45.3 cm3
Molar Volume: 153.9 cm3
Surface Tension: 35.2 dyne/cm
Density: 1.584 g/cm3
Flash Point: 110.8 °C
Enthalpy of Vaporization: 46.17 kJ/mol
Boiling Point: 244.1 °C at 760 mmHg
Vapour Pressure: 0.0483 mmHg at 25°C
EINECS: 211-067-2
Melting point: −2-2.5 °C(lit.)
Product Categories: Industrial/Fine Chemicals; Dibromoalkane; Bromine Compounds; alpha,omega-Bifunctional Alkanes; alpha,omega-Dibromoalkanes; Monofunctional & alpha,omega-Bifunctional Alkanes

Toxicity Data With Reference

1.    

skn-rbt 500 mg MLD

    FCTOD7    Food and Chemical Toxicology. 20 (1982),563.
2.    

eye-rbt 100 mg MLD

    FCTOD7    Food and Chemical Toxicology. 20 (1982),573.
3.    

eye-rbt 100 mg/30S rns MLD

    FCTOD7    Food and Chemical Toxicology. 20 (1982),573.
4.    

mmo-sat 10 µmol/plate

    MUREAV    Mutation Research. 141 (1984),11.
5.    

ipr-mus LD50:270 mg/kg

    ARZNAD    Arzneimittel-Forschung. Drug Research. 14 (1964),668.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Poison by intraperitoneal route. A skin and eye irritant. Mutation data reported. When heated to decomposition it emits very toxic fumes of Br. See also BROMIDES.
Hazard Codes: ToxicT,DangerousN,CorrosiveC
Risk Statements: 25-51/53
R25 :Toxic if swallowed. 
R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
Safety Statements: 36-45-61
S36:Wear suitable protective clothing. 
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) 
S61:Avoid release to the environment. Refer to special instructions / safety data sheets.
RIDADR: UN 2810 6.1/PG 3
WGK Germany: 3
RTECS: MO1515000
HazardClass: 9
PackingGroup; III
HS Code: 29033036

Specification

  1,6-Dibromohexane , with CAS number of 629-03-8, can be called Hexamethylene dibromide ; 1,6-Dibromo-n-hexane ; a,w-Dibromohexane . It is a colourless or pale yellow liquid. 1,6-Dibromohexane (CAS NO.629-03-8) can be used as intermediates in organic synthesis, or for the production of lowering blood pressure drug-Rokko bromide .