2,2-dideuterio-2-phenylacetic acid

Modify Date: 2025-08-25 19:18:51

2,2-dideuterio-2-phenylacetic acid Structure
2,2-dideuterio-2-phenylacetic acid structure
 Common Name 2,2-dideuterio-2-phenylacetic acid
CAS Number 1076-07-9 Molecular Weight 138.16000
Density 1.182g/cm3 Boiling Point 265.5ºC at 760 mmHg
Molecular Formula C8H6D2O2 Melting Point 76-78ºC(lit.)
MSDS Chinese USA Flash Point 156.2ºC
Symbol GHS07
GHS07		 Signal Word Warning

 Names

Name 2,2-dideuterio-2-phenylacetic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.182g/cm3
Boiling Point 265.5ºC at 760 mmHg
Melting Point 76-78ºC(lit.)
Molecular Formula C8H6D2O2
Molecular Weight 138.16000
Flash Point 156.2ºC
Exact Mass 138.06500
PSA 37.30000
LogP 1.31370
Vapour Pressure 0.00456mmHg at 25°C
Index of Refraction 1.552

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305 + P351 + P338
Hazard Codes Xi: Irritant;
Risk Phrases R36/37/38
Safety Phrases 26-36
RIDADR UN 3335

 Synthetic Route

Phenylacetic acid structure

Phenylacetic acid

CAS#:103-82-2

~96%

2,2-dideuterio-2-phenylacetic acid Structure

2,2-dideuterio-...

CAS#:1076-07-9

Literature: Flakus, Henryk T.; Chelmecki, Michal Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy, 2002 , vol. 58, # 9 p. 1867 - 1880
Sodium phenylacetate structure

Sodium phenylacetate

CAS#:114-70-5

~%

2,2-dideuterio-2-phenylacetic acid Structure

2,2-dideuterio-...

CAS#:1076-07-9

Literature: Zamojski, Aleksander; Grzeszczyk, Barbara; Banaszek, Anna; Babinski, Jakub; Bordas, Xavier; et. al. Carbohydrate Research, 1985 , vol. 142, p. 165 - 171
Carbon dioxide structure

Carbon dioxide

CAS#:124-38-9

BENZYL-α,α-D2 CHLORIDE structure

BENZYL-α,α-D2 C...

CAS#:33712-34-4

~63%

2,2-dideuterio-2-phenylacetic acid Structure

2,2-dideuterio-...

CAS#:1076-07-9

Literature: Heesing, Albert; Muellers, Wolfgang Chemische Berichte, 1980 , vol. 113, # 1 p. 9 - 18
Benzyl cyanide structure

Benzyl cyanide

CAS#:140-29-4

~%

2,2-dideuterio-2-phenylacetic acid Structure

2,2-dideuterio-...

CAS#:1076-07-9

Literature: Kim, Sung Soo; Tuchkin, Alexey Journal of Organic Chemistry, 1999 , vol. 64, # 11 p. 3821 - 3824
Phenyl(2H2)methanol structure

Phenyl(2H2)methanol

CAS#:21175-64-4

~%

2,2-dideuterio-2-phenylacetic acid Structure

2,2-dideuterio-...

CAS#:1076-07-9

Literature: Dneprovskii, A. S.; Eliseenkov, E. V.; Mil'tsov, S. A. Journal of Organic Chemistry USSR (English Translation), 1982 , vol. 18, p. 317 - 324 Zhurnal Organicheskoi Khimii, 1982 , vol. 18, # 2 p. 365 - 373
Ethyl benzoate structure

Ethyl benzoate

CAS#:93-89-0

~%

2,2-dideuterio-2-phenylacetic acid Structure

2,2-dideuterio-...

CAS#:1076-07-9

Literature: Dneprovskii, A. S.; Eliseenkov, E. V.; Mil'tsov, S. A. Journal of Organic Chemistry USSR (English Translation), 1982 , vol. 18, p. 317 - 324 Zhurnal Organicheskoi Khimii, 1982 , vol. 18, # 2 p. 365 - 373
Methyl benzoate structure

Methyl benzoate

CAS#:93-58-3

~%

2,2-dideuterio-2-phenylacetic acid Structure

2,2-dideuterio-...

CAS#:1076-07-9

Literature: Heesing, Albert; Muellers, Wolfgang Chemische Berichte, 1980 , vol. 113, # 1 p. 9 - 18
Carbon dioxide structure

Carbon dioxide

CAS#:124-38-9

Phenyl(2H2)methanol structure

Phenyl(2H2)methanol

CAS#:21175-64-4

~%

2,2-dideuterio-2-phenylacetic acid Structure

2,2-dideuterio-...

CAS#:1076-07-9

Literature: Gessner, Uwe; Heesing, Albert Chemische Berichte, 1985 , vol. 118, # 7 p. 2593 - 2606

 Synonyms

MFCD00075154
Phenylacetic-2,2-d2 acid
Phenylacetic acid-|A,|A-d2
<2,2-D2>Phenylessigsaeure
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