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27973-29-1

Basic Information
CAS No.: 27973-29-1
Name: 1,6-Dibromopyrene
Article Data: 53
Cas Database
Molecular Structure:
Molecular Structure of 27973-29-1 (1,6-Dibromopyrene)
Formula: C16H8Br2
Molecular Weight: 360.048
Synonyms: pyrene, 1,6-dibromo-;
EINECS: 1308068-626-2
Density: 1.852 g/cm3
Melting Point: 228.0 to 232.0 °C
Boiling Point: 469.6 °C at 760 mmHg
Flash Point: 277.3 °C
Solubility: N/A
Appearance: White to off-white powder
Hazard Symbols: N/A
Risk Codes: 36/37/38
Safety: 26-36/37/39
Transport Information: N/A
PSA: 0.00000
LogP: 6.10900
Synthetic route
129-00-0

pyrene

A

27973-29-1

1,6-dibromopyrene

B

38303-35-4

1,8-dibromopyrene

Conditions
ConditionsYield
With carbon disulfide; bromine at 20℃; for 17h;A 15%
B 85%
With carbon disulfide; bromine at 20℃; for 17h;A 15%
B 85%
With bromine In chloroform for 4h; Inert atmosphere; Reflux;A 71.1%
B 20%

C18H16Br2O2

27973-29-1

1,6-dibromopyrene

Conditions
ConditionsYield
With methanesulfonic acid In dichloromethane at 0 - 20℃; for 1h; Inert atmosphere;82.2%

C24H28Br2O2

27973-29-1

1,6-dibromopyrene

Conditions
ConditionsYield
With methanesulfonic acid In dichloromethane at 0 - 20℃; for 1h; Inert atmosphere;78.33%
129-00-0

pyrene

27973-29-1

1,6-dibromopyrene

Conditions
ConditionsYield
With bromine In dichloromethane at 20℃; for 30h;64%
With bromine In tetrachloromethane at 110℃; for 12h; Darkness;63%
With bromine In chloroform at 23℃; for 8h;63%

1-hydropyrenyl

27973-29-1

1,6-dibromopyrene

Conditions
ConditionsYield
With bromine In chloroform at 20℃;30%
1714-29-0

1-bromopyrene

A

38037-54-6

1,3-dibromopyrene

B

27973-29-1

1,6-dibromopyrene

C

38303-35-4

1,8-dibromopyrene

Conditions
ConditionsYield
With bromine In dichloromethane for 5h; Ambient temperature;A 3 % Spectr.
B 53 % Spectr.
C 44 % Spectr.
42882-08-6

1-amino-6-bromopyrene

27973-29-1

1,6-dibromopyrene

Conditions
ConditionsYield
(i) NaNO2, aq. H2SO4, DMF, (ii) CuBr, KBr, aq. HBr; Multistep reaction;
129-00-0

pyrene

75-09-2

dichloromethane

7726-95-6

bromine

A

27973-29-1

1,6-dibromopyrene

B

38303-35-4

1,8-dibromopyrene

1714-29-0

1-bromopyrene

A

27973-29-1

1,6-dibromopyrene

B

38303-35-4

1,8-dibromopyrene

C

38303-36-5

1,3,6-tribromopyrene

Conditions
ConditionsYield
With sodium hypochlorite; potassium bromide In methanol for 24h; pH=5;A n/a
B n/a
C 20 mg
42882-03-1

1-bromo-6-nitropyrene

27973-29-1

1,6-dibromopyrene

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: N2H4*H2O / Raney-Ni
2: (i) NaNO2, aq. H2SO4, DMF, (ii) CuBr, KBr, aq. HBr
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    Product Name: 1,6-Dibromopyrene Synonyms: 6-DibroMopyrene;Pyrene, 1,6-dibromo-;1,6-Dibromopyrene;1,6-dlbrornopyrone;1,6-Dibromopyrene>;1,6-dibromopyrene fandachem;1,6-Dibromopyrene ISO 9001:2015 REACH CAS: 27973-29-1 MF: C16H8Br2 MW:

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Chemistry

Molecular Structure of 1,6-Dibromopyrene (CAS NO.27973-29-1):

IUPAC Name: 1,6-dibromopyrene 
Empirical Formula: C16H8Br2
Molecular Weight: 360.0427
H bond acceptors: 0
H bond donors: 0
Freely Rotating Bonds: 0
Polar Surface Area: 0 Å2
Index of Refraction: 1.863
Molar Refractivity: 87.84 cm3
Molar Volume: 194.3 cm3
Surface Tension: 64.4 dyne/cm
Density: 1.852 g/cm3
Flash Point: 277.3 °C
Enthalpy of Vaporization: 70.4 kJ/mol
Boiling Point: 469.6 °C at 760 mmHg
Vapour Pressure: 1.54E-08 mmHg at 25°C
InChI
InChI=1/C16H8Br2/c17-13-8-4-10-2-6-12-14(18)7-3-9-1-5-11(13)16(10)15(9)12/h1-8H
Smiles
c1(ccc2ccc3c(ccc4ccc1c2c34)Br)Br

Specification

 1,6-Dibromopyrene , with CAS number of 27973-29-1, can be called pyrene, 1,6-dibromo- .

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