2-nitrocinnamic Acid

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Names

[ CAS No. ]:
612-41-9

[ Name ]:
2-nitrocinnamic Acid

[Synonym ]:
2-Propenoic acid, 3-(2-nitrophenyl)-, (2E)-
2-Propenoic acid, 3- (2-nitrophenyl)-
cinnamic acid, o-nitro-
(2E)-3-(2-Nitrophenyl)acrylic acid
EINECS 210-309-4
2-nitrocinnamic Acid
MFCD00007189

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
383.3±25.0 °C at 760 mmHg

[ Melting Point ]:
243-245 °C(lit.)

[ Molecular Formula ]:
C9H7NO4

[ Molecular Weight ]:
193.156

[ Flash Point ]:
171.8±11.6 °C

[ Exact Mass ]:
193.037506

[ PSA ]:
83.12000

[ LogP ]:
1.96

[ Vapour Pressure ]:
0.0±0.9 mmHg at 25°C

[ Index of Refraction ]:
1.655

[ Storage condition ]:
2-8°C

[ Water Solubility ]:
insoluble

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UD3642850
CHEMICAL NAME :
2-Propenoic acid, 3-(2-nitrophenyl)-
CAS REGISTRY NUMBER :
612-41-9
LAST UPDATED :
199806
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H7-N-O4
MOLECULAR WEIGHT :
193.17

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>350 mg/kg
TOXIC EFFECTS :
Behavioral - changes in motor activity (specific assay) Behavioral - ataxia Behavioral - rigidity (including catalepsy)
REFERENCE :
IJSIDW Indian Journal of Pharmaceutical Sciences. (Kalina, Santa Cruz (East), Bombay 400 029, India) V.40(2)- 1978- Volume(issue)/page/year: 49,77,1987

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter

[ Hazard Codes ]:
Xi:Irritant

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S22-S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
UD3642850

[ HS Code ]:
29163900

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • acetic acid
  • 2-Nitrobenzaldehyde
  • Malonic acid
  • o-Nitrocinnamaldehyde
  • METHYL 2-NITROCINNAMATE
  • 2-Propenoic acid, 3-(2-nitrophenyl)-, 1,1-dimethylethyl ester, (2E)
  • Ethanoic anhydride
  • 2-Nitroaniline
  • Cinnamic acid

DownStream

  • (4-nitrophenyl) 3-(2-nitrophenyl)prop-2-enoate
  • Benzenamine, 2-ethenyl-
  • FGIN-1-27
  • 3,4-Dihydroquinolin-2(1H)-one
  • 2-Nitrobenzoic acid
  • Glyoxylic acid
  • 2-Nitrobenzaldehyde
  • Succinic acid
  • isatin
  • 2-Propenoic acid,3-(2-nitrophenyl)-, ethyl ester

Customs

[ HS Code ]: 2916399090

[ Summary ]:
2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Related Compounds

  • 2-Nitrocinnamic Acid
  • cis-2-Nitrocinnamic acid
  • 4-BROMO-2-NITROCINNAMIC ACID
  • 5-chloro-2-nitrocinnamic acid
  • 5-methoxy-2-nitrocinnamic acid
  • 2-nitrocinnamic acid ethyl ester
  • 2-(2,3-Dimethoxyphenyl)prop-2-en-1-amine
  • 1,2-Dimethoxy-3-(2-methylbut-3-yn-2-yl)benzene
  • 3-[(5-Methyl-1,2-oxazol-3-yl)methyl]piperidin-3-ol
  • Methyl 4-amino-3-(5-methyl-1,2-oxazol-3-yl)butanoate
  • (1R)-3-amino-1-(3-ethoxy-2-methoxyphenyl)propan-1-ol
  • N-methyl-1-(4-methylpyridin-3-yl)cyclopropan-1-amine
  • 2-Methyl-4-(4-methylpyridin-3-yl)butanoic acid
  • 1-[1-(4-Methylpyridin-3-yl)cyclopropyl]ethan-1-ol
  • 3-(2-Fluoropyridin-3-yl)-3-hydroxypropanenitrile
  • 2-Fluoro-3-[(oxiran-2-yl)methyl]pyridine
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