(2H5)Benzoic acid

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Names

[ CAS No. ]:
1079-02-3

[ Name ]:
(2H5)Benzoic acid

[Synonym ]:
Benzoic-d acid
pentadeuterated benzoic acid
(H)Benzoic acid
Benzoic-d5 acid
MFCD00002400
1,2,3,4,5-pentadeuteriobenzoic acid
EINECS 214-089-0
2,3,4,5,6-pentadeuteriobenzoic acid
ring deuterated benzoic acid
d5-benzoic acid

Chemical & Physical Properties

[ Density]:
1.2±0.1 g/cm3

[ Boiling Point ]:
249.3±9.0 °C at 760 mmHg

[ Melting Point ]:
121-125ºC(lit.)

[ Molecular Formula ]:
C7HD5O2

[ Molecular Weight ]:
127.152

[ Flash Point ]:
121.1±0.0 °C

[ Exact Mass ]:
127.068161

[ PSA ]:
37.30000

[ LogP ]:
1.89

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.564

[ Storage condition ]:
Refrigerator

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS05, GHS07, GHS08

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H302-H315-H317-H318-H334-H335

[ Precautionary Statements ]:
P261-P280-P305 + P351 + P338-P342 + P311

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Faceshields;Gloves

[ Hazard Codes ]:
Xn

[ Risk Phrases ]:
R22

[ Safety Phrases ]:
S22-S26-S36

[ WGK Germany ]:
3

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • bromobenzene-d5
  • Carbon dioxide
  • benzoic acid
  • 1,2,3,4,5-pentadeuterio-6-methylbenzene
  • Toluene-d8
  • Sodium Benzoate
  • Benzene-d6
  • Phenyl-d5-magnesium bromide

DownStream

  • (2H5)Benzoyl chloride
  • (3-NITRO-PHENYL)-(4-NITRO-PHENYL)-ETHER
  • Benzaldehyde
  • Benzaldehyde
  • Benzyl-d5 Bromide
  • Benzyl-d7 alcohol
  • 3-Nitrobenzoic acid-d4
  • Benzyl-d5 Chloride
  • methyl benzoate-2,3,4,5,6-d5

Articles

Carbon dioxide utilization via carbonate-promoted C-H carboxylation.

Nature 531 , 215-9, (2016)

Using carbon dioxide (CO2) as a feedstock for commodity synthesis is an attractive means of reducing greenhouse gas emissions and a possible stepping-stone towards renewable synthetic fuels. A major i...


More Articles

Related Compounds

  • (2H5)Ethyl 4-hydroxybenzoate
  • (trifluoromethyl)benzoic acid
  • pentamethyl-benzoic acid methyl ester
  • 4-Amino-5-chloro-2-ethoxybenzoic Acid-d5
  • 1-(2H5)Ethyl-1H-pyrrole-2,5-dione
  • N-Benzy N,N-Didesmethyl Trimebutine-d5
  • rac-(2R,5S)-1-[(prop-2-en-1-yloxy)carbonyl]-5-(pyridin-3-yl)pyrrolidine-2-carboxylic acid
  • 2-{Cyclopropyl[(prop-2-en-1-yloxy)carbonyl]amino}-2-(pyridin-3-yl)acetic acid
  • 8-(2,2,2-Trifluoroacetyl)-5-oxa-8-azaspiro[3.5]nonane-7-carboxylic acid
  • 8-(2,2,2-Trifluoroacetyl)-5-oxa-8-azaspiro[3.5]nonane-9-carboxylic acid
  • (2S,4S)-1-[(prop-2-en-1-yloxy)carbonyl]-4-(trifluoromethyl)pyrrolidine-2-carboxylic acid
  • 2-methyl-3-[3-(N-methylacetamido)piperidin-1-yl]propanoic acid
  • Tert-butyl 3-(3-amino-5-methylpiperidin-1-yl)propanoate
  • 4-(chloromethyl)-3-(2,2-dimethylbutyl)-1H-pyrazole
  • (3S)-4-(tert-butoxy)-3-acetamidobutanoic acid
  • ethyl (2S)-2-amino-3-(3-bromo-4-hydroxyphenyl)propanoate
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