(2E)-4-Hydroxy-2-nonenal

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Names

[ CAS No. ]:
75899-68-2

[ Name ]:
(2E)-4-Hydroxy-2-nonenal

[Synonym ]:
(2E)-4-Hydroxynon-2-enal
2-Nonenal, 4-hydroxy-, (E)-
4-hydroxy-trans-2-nonenal
4-hydroxy-2E-nonenal
4-hydroxy-2,3-trans-nonenal
4-hydroxy-2-nonena
4-hydroxynon-2-enal
MFCD00211020
2-Nonenal, 4-hydroxy-, (2E)-
(E)-4-hydroxynon-2-enal
4-hydroxynonenal
4-HYDROXY-2-NONENAL

Chemical & Physical Properties

[ Density]:
0.9±0.1 g/cm3

[ Boiling Point ]:
275.6±23.0 °C at 760 mmHg

[ Molecular Formula ]:
C9H16O2

[ Molecular Weight ]:
156.222

[ Flash Point ]:
115.2±15.2 °C

[ Exact Mass ]:
156.115036

[ PSA ]:
37.30000

[ LogP ]:
1.85

[ Vapour Pressure ]:
0.0±1.3 mmHg at 25°C

[ Index of Refraction ]:
1.460

[ Storage condition ]:
-70°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RA8510000
CHEMICAL NAME :
2-Nonenal, 4-hydroxy-
CAS REGISTRY NUMBER :
75899-68-2
LAST UPDATED :
199410
DATA ITEMS CITED :
11
MOLECULAR FORMULA :
C9-H16-O2
MOLECULAR WEIGHT :
156.25
WISWESSER LINE NOTATION :
VH1U1YQ5

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
35 mg/kg
TOXIC EFFECTS :
Behavioral - fluid intake Blood - changes in cell count (unspecified) Nutritional and Gross Metabolic - metabolic acidosis
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
69 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
Mutation test systems - not otherwise specified
TEST SYSTEM :
Rodent - guinea pig Cells - not otherwise specified
DOSE/DURATION :
100 umol/L
REFERENCE :
CBINA8 Chemico-Biological Interactions. (Elsevier Scientific Pub. Ireland Ltd., POB 85, Limerick, Ireland) V.1- 1969- Volume(issue)/page/year: 52,233,1984

Safety Information

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R36/37/38:Irritating to eyes, respiratory system and skin .

[ Safety Phrases ]:
S26-S37/39

[ HS Code ]:
2912491000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Oct-1-en-3-ol
  • acrolein
  • 1-Bromopentane
  • 4,4-dimethoxybut-2-enal
  • (methoxymethyl)triphenylphosphonium chloride
  • 2,3-epoxyoctanal

DownStream

  • 4-HYDROXY NONENAL MERCAPTURIC ACID
  • 2-Amylfuran
  • 3,5-dihydroimidazo[2,1-b]purin-4-one

Customs

[ HS Code ]: 2912491000

[ Summary ]:
2912491000. other aldehyde-alcohols. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

Related Compounds

  • (2E)-4-Hydroxy-2-nonen-8-ynal
  • (2E)-4-Hydroxy(9,9,9-2H3)-2-nonenal
  • 4-hydroxyhexenal
  • (4-hydroxy-2-methylbut-2-enyl)-triphenylphosphanium,bromide
  • 4-hydroxy-2-methylbut-2-enoic acid ethyl ester
  • (E)-4-hydroxybut-2-enoic acid
  • N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-(5-ethoxy-1-methyl-2,4-dioxo-1,2-dihydropyrido[2,3-d]pyrimidin-3(4H)-yl)acetamide
  • 2-(5-ethoxy-1-methyl-2,4-dioxo-1,2-dihydropyrido[2,3-d]pyrimidin-3(4H)-yl)-N-(2-(trifluoromethyl)phenyl)acetamide
  • 2-(5-ethoxy-1-methyl-2,4-dioxo-1,2-dihydropyrido[2,3-d]pyrimidin-3(4H)-yl)-N-(4-(trifluoromethyl)phenyl)acetamide
  • N-methoxy-N,2,2-trimethylpent-4-enamide
  • 2-(5-ethoxy-1-methyl-2,4-dioxo-1,2-dihydropyrido[2,3-d]pyrimidin-3(4H)-yl)-N-(4-(trifluoromethoxy)phenyl)acetamide
  • methyl 4-(2-(5-ethoxy-1-methyl-2,4-dioxo-1,2-dihydropyrido[2,3-d]pyrimidin-3(4H)-yl)acetamido)benzoate
  • 4-bromo-N-(4-{[4-(ethylamino)-6-methylpyrimidin-2-yl]amino}phenyl)benzamide
  • N-(4-acetylphenyl)-2-(5-ethoxy-1-methyl-2,4-dioxo-1,2-dihydropyrido[2,3-d]pyrimidin-3(4H)-yl)acetamide
  • N-(3-acetamidophenyl)-2-(5-ethoxy-1-methyl-2,4-dioxo-1,2-dihydropyrido[2,3-d]pyrimidin-3(4H)-yl)acetamide
  • N-cyclohexyl-2-(5-ethoxy-1-methyl-2,4-dioxopyrido[2,3-d]pyrimidin-3-yl)acetamide
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