1,2,3,4,5-pentadeuterio-6-ethenylbenzene

Modify Date: 2026-07-01 17:51:02

1,2,3,4,5-pentadeuterio-6-ethenylbenzene Structure
1,2,3,4,5-pentadeuterio-6-ethenylbenzene structure
Common Name 1,2,3,4,5-pentadeuterio-6-ethenylbenzene
CAS Number 5161-29-5 Molecular Weight 109.18000
Density 0.952 g/mL at 25ºC(lit.) Boiling Point 50-51ºC 25 mm Hg(lit.)
Molecular Formula C8H3D5 Melting Point N/A
MSDS Chinese USA Flash Point 88 °F
Symbol GHS02 GHS07 GHS08
GHS02, GHS07, GHS08
Signal Word Danger

 Names

Name 1,2,3,4,5-pentadeuterio-6-ethenylbenzene
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.952 g/mL at 25ºC(lit.)
Boiling Point 50-51ºC 25 mm Hg(lit.)
Molecular Formula C8H3D5
Molecular Weight 109.18000
Flash Point 88 °F
Exact Mass 109.09400
LogP 2.32960
InChIKey PPBRXRYQALVLMV-DKFMXDSJSA-N
SMILES C=Cc1ccccc1

 Safety Information

Symbol GHS02 GHS07 GHS08
GHS02, GHS07, GHS08
Signal Word Danger
Hazard Statements H226-H315-H319-H332-H361d-H372
Precautionary Statements P210-P260-P280-P305 + P351 + P338-P370 + P378
Target Organs Missing Phrase - TD-124117
Hazard Codes Xn: Harmful;
Risk Phrases R10
Safety Phrases 23
RIDADR UN 2055 3
WGK Germany 2

 Synthetic Route

~66%

1,2,3,4,5-pentadeuterio-6-ethenylbenzene Structure

1,2,3,4,5-penta...

CAS#:5161-29-5

Learn More
Literature: Wright, Joseph A.; Gaunt, Matthew J.; Spencer, Jonathan B. Chemistry - A European Journal, 2006 , vol. 12, # 3 p. 949 - 955

~%

1,2,3,4,5-pentadeuterio-6-ethenylbenzene Structure

1,2,3,4,5-penta...

CAS#:5161-29-5

Learn More
Literature: Wright, Joseph A.; Gaunt, Matthew J.; Spencer, Jonathan B. Chemistry - A European Journal, 2006 , vol. 12, # 3 p. 949 - 955

~%

1,2,3,4,5-pentadeuterio-6-ethenylbenzene Structure

1,2,3,4,5-penta...

CAS#:5161-29-5

Learn More
Literature: Depke, Gisbert; Klose, Walter; Schwarz, Helmut; Blum, Wolfgang; Richter, Wilhelm J. Organic Mass Spectrometry, 1983 , vol. 18, # 12 p. 568 - 571

~%

1,2,3,4,5-pentadeuterio-6-ethenylbenzene Structure

1,2,3,4,5-penta...

CAS#:5161-29-5

Learn More
Literature: Nakaoki, Takahiko; Kobayashi, Masamichi Journal of Molecular Structure, 1991 , vol. 242, # 1 p. 315 - 331

~%

1,2,3,4,5-pentadeuterio-6-ethenylbenzene Structure

1,2,3,4,5-penta...

CAS#:5161-29-5

Learn More
Literature: Noda; Sala Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy, 2000 , vol. 56, # 1 p. 145 - 155

~%

1,2,3,4,5-pentadeuterio-6-ethenylbenzene Structure

1,2,3,4,5-penta...

CAS#:5161-29-5

Learn More
Literature: Nakaoki, Takahiko; Kobayashi, Masamichi Journal of Molecular Structure, 1991 , vol. 242, # 1 p. 315 - 331

~%

1,2,3,4,5-pentadeuterio-6-ethenylbenzene Structure

1,2,3,4,5-penta...

CAS#:5161-29-5

Learn More
Literature: Baether, Wolfgang; Kuck, Dietmar; Gruetzmacher, Hans-Fr. Organic Mass Spectrometry, 1985 , vol. 20, # 9 p. 572 - 577

 Synonyms

Styrole-d5
Styrolene-d5
styrene-ar-d5
Cinnamene-d5
Styrene-2,3,4,5,6-d5
Phenylethene-d5
Vinylbenzene-d5
Phenethylene-d5
Styrene-d5
styrene-ring-d5
Vinylbenzol-d5
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