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Basic Information
CAS No.: 1111-72-4
Name: Carbon-13C dioxide
Molecular Structure:
Molecular Structure of 1111-72-4 (Carbon-13C dioxide)
Formula: CO2
Molecular Weight: 44.9988
Synonyms: Carbondioxide (13C16O2); Carbon dioxide (13CO2); Carbon dioxide-13C; Carbondioxide-C13; Carbon-13 dioxide; [13C]-Carbon dioxide
Density: 1.52 (vs air)
Melting Point: −78 °C (subl.)(lit.)
Safety:
Safety Statements 9
RIDADR UN 1013 2.2
WGK Germany 3
4.5
PSA: 34.14000
LogP: -0.58350
Synthetic route
1260102-76-8

C8(13)CH12O2

A

1-phenyl-[3-13C]propan-1-one

B

1111-72-4

carbon dioxide

C

98-86-2

acetophenone

Conditions
ConditionsYield
Ru(TFA)2(CO)(PPh3)3; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene In (2)H8-toluene at 175℃; for 17h; Product distribution / selectivity; Inert atmosphere;A 63%
B n/a
C 23%
121920-67-0

Ir2(μ-CO3)(CO)2{bis(dimethylphosphino)methane}2

1641-69-6

[13C]Carbon monoxide

A

121920-65-8

Ir2(CO)4(bis(dimethylphosphino)methane)2

B

124-38-9

carbon dioxide

C

1111-72-4

carbon dioxide

Conditions
ConditionsYield
In acetonitrile 25°C; gas chromy./mass spectroscopy;A n/a
B 50%
C 50%
6933-23-9

[α-13C]toluene

A

124-38-9

carbon dioxide

B

1111-72-4

carbon dioxide

Conditions
ConditionsYield
With oxygen In solid matrix for 3h; Product distribution; Irradiation;

C7(13)CH9NO2*C7H9N

A

1111-72-4

carbon dioxide

B

C7(13)CH9NO2

C

100-46-9

benzylamine

Conditions
ConditionsYield
In tetrahydrofuran Further byproducts given. Title compound not separated from byproducts;
153791-58-3

2,2-dimethyl-5--1,3-dioxane-4,6-dione<4,6-13C2>

A

1111-72-4

carbon dioxide

B

124-40-3

dimethyl amine

C

67-64-1

acetone

D

C8(13)CH5NO

Conditions
ConditionsYield
at 500℃; flash vacuum pyrolysis; Title compound not separated from byproducts;

C14(13)CH12N2O2

A

1111-72-4

carbon dioxide

B

1,2-diphenyl ethanediimine

Conditions
ConditionsYield
In trichlorofluoromethane; acetone at -88℃; Product distribution;

C14(13)CH12(15)N2O2

A

1111-72-4

carbon dioxide

B

(15)N-1,2-diphenyl ethanediimine

Conditions
ConditionsYield
In trichlorofluoromethane; acetone at -88℃; Product distribution; Thermolysis;
Conditions
ConditionsYield
With sulfuric acid; ozone In water pH=2.5; Product distribution; Further Variations:; pH-values; Reagents;
105931-74-6

[2-13C]-D-glucopyranoside

A

124-38-9

carbon dioxide

B

1111-72-4

carbon dioxide

Conditions
ConditionsYield
With sulfuric acid; ozone In water pH=2.5; Product distribution; Further Variations:; pH-values; Reagents;

<6-13C> Glucose

A

124-38-9

carbon dioxide

B

1111-72-4

carbon dioxide

Conditions
ConditionsYield
With sulfuric acid; ozone In water pH=2.5; Product distribution; Further Variations:; pH-values; Reagents;
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