Isoferulic acid

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Names

[ CAS No. ]:
537-73-5

[ Name ]:
Isoferulic acid

[Synonym ]:
3'-hydroxy-4'-methoxy cinnamic acid
Hesperitinic acid
trans-Isoferulic acid
2-Propenoic acid, 3-(3-hydroxy-4-methoxyphenyl)-, (2E)-
RARECHEM BK HW 0093
trans-3-hydroxy-4-methoxycinnamic acid
3-Hydroxy-4-MethoxycinnaMic Acid
3-(3-Hydroxy-4-methoxyphenyl)acrylic acid
3-Hydroxy-4-methoxycinnamic
Isoferulic acid
HESPERETINIC ACID
Isoferulate
MFCD00004391
EINECS 208-676-0
Isoferulic
Caffeic acid 4-methyl ether
(2E)-3-(3-Hydroxy-4-methoxyphenyl)acrylic acid
3-(3-Hydroxy-4-methoxyphenyl)-2-propenoic acid
Hesperetic acid
(2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid
3-hydroxy-4-methoxy-Cinnamic acid

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
410.2±35.0 °C at 760 mmHg

[ Melting Point ]:
230 °C (dec.)(lit.)

[ Molecular Formula ]:
C10H10O4

[ Molecular Weight ]:
194.184

[ Flash Point ]:
167.6±19.4 °C

[ Exact Mass ]:
194.057907

[ PSA ]:
66.76000

[ LogP ]:
1.56

[ Vapour Pressure ]:
0.0±1.0 mmHg at 25°C

[ Index of Refraction ]:
1.627

[ Storage condition ]:
-20?C Freezer

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UD3365400
CHEMICAL NAME :
2-Propenoic acid, 3-(3-hydroxy-4-methoxyphenyl)-
CAS REGISTRY NUMBER :
537-73-5
BEILSTEIN REFERENCE NO. :
2212760
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C10-H10-O4
MOLECULAR WEIGHT :
194.20

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
7900 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity)
REFERENCE :
YKKZAJ Yakugaku Zasshi. Journal of Pharmacy. (Nippon Yakugakkai, 2-12-15 Shibuya, Shibuya-ku, Tokyo 150, Japan) No.1- 1881- Volume(issue)/page/year: 95,539,1975
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
8100 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity)
REFERENCE :
YKKZAJ Yakugaku Zasshi. Journal of Pharmacy. (Nippon Yakugakkai, 2-12-15 Shibuya, Shibuya-ku, Tokyo 150, Japan) No.1- 1881- Volume(issue)/page/year: 95,539,1975

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

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

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S37/39-S24/25

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ RTECS ]:
UD3365400

[ HS Code ]:
29189090

Precursor & DownStream

Precursor

  • Isovanillin
  • Malonic acid
  • Ethyl 3-(3-Hydroxy-4-Methoxyphenyl)-2-propenoate
  • isoferulic acid 3-O-glucopyranoside
  • 3-amino-4-methoxy-cinnamic acid
  • isoferulic acid methyl ester
  • Hesperidin
  • 4-METHOXY-3-NITROCINNAMIC ACID
  • 3,4-Dihydroxybenzaldehyde
  • acetic acid

DownStream

  • protocatechuic acid
  • acetic acid
  • 2-Propenoic acid,3-(3,4-dimethoxyphenyl)-, methyl ester
  • 3-(3-Hydroxy-4-methoxyphenyl)propanoic acid
  • Methyl 3-(3-Hydroxy-4-methoxyphenyl)propanoate
  • Methyl 3-(3-Hydroxy-4-Methoxyphenyl)acrylate
  • 1-diazonio-4-(4-methoxy-3-phenylmethoxyphenyl)but-1-en-2-olate
  • 3,3',4,4',5,5'-Hexakismethoxy-1,1'-biphenyl
  • Benzenepropanoic acid, 4-methoxy-3-(phenylmethoxy)-,methyl ester

Customs

[ HS Code ]: 2918990090

[ Summary ]:
2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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Related Compounds

  • Isoferulic acid
  • isoferulic acid
  • trans-Isoferulic acid-d3
  • Isoferulic Acid 3-O-Sulfate
  • isoferulic acid ethyl ester
  • isoferulic acid methyl ester
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • (2S)-3-(pyridin-2-yl)-2-(2,2,2-trifluoroacetamido)propanoic acid
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