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Technology Process of (E)-3-[(1R,4S,7R,7aR)-1-acetyloxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid

(E)-3-[(1R,4S,7R,7aR)-1-acetyloxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid

Base Information
  • Chemical Name:(E)-3-[(1R,4S,7R,7aR)-1-acetyloxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid
  • CAS No.:81397-67-3
  • Molecular Formula:C17H24 O4
  • Molecular Weight:292.3701
  • Hs Code.:
  • DSSTox Substance ID:DTXSID3033145
  • Nikkaji Number:J933.948E
  • Wikidata:Q81984050
  • ChEMBL ID:CHEMBL1401208
  • Mol file:81397-67-3.mol
(E)-3-[(1R,4S,7R,7aR)-1-acetyloxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid

Synonyms:acetylvalerenolic acid

Suppliers and Price of (E)-3-[(1R,4S,7R,7aR)-1-acetyloxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid
Supply Marketing:
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
  • Packaging
  • price
  • Sigma-Aldrich
  • Acetoxyvalerenic acid analytical standard
  • 10 mg
  • $ 389.00
  • Biosynth Carbosynth
  • Acetoxyvalerenic acid - Valeriana officinalis (common valerian)
  • 5 mg
  • $ 150.00
  • Biosynth Carbosynth
  • Acetoxyvalerenic acid - Valeriana officinalis (common valerian)
  • 2 mg
  • $ 75.00
  • Biosynth Carbosynth
  • Acetoxyvalerenic acid - Valeriana officinalis (common valerian)
  • 10 mg
  • $ 250.00
  • Biosynth Carbosynth
  • Acetoxyvalerenic acid - Valeriana officinalis (common valerian)
  • 25 mg
  • $ 450.00
  • Biosynth Carbosynth
  • Acetoxyvalerenic acid - Valeriana officinalis (common valerian)
  • 50 mg
  • $ 750.00
  • American Custom Chemicals Corporation
  • ACETOXYVALERENIC ACID 95.00%
  • 5MG
  • $ 502.94
  • AK Scientific
  • Acetoxyvalerenic acid
  • 2mg
  • $ 185.00
Total 17 raw suppliers
Chemical Property of (E)-3-[(1R,4S,7R,7aR)-1-acetyloxy-3,7-dimethyl-2,4,5,6,7,7a-hexahydro-1H-inden-4-yl]-2-methylprop-2-enoic acid
Chemical Property:
  • Vapor Pressure:1.73E-08mmHg at 25°C 
  • Boiling Point:427 °C at 760 mmHg 
  • Flash Point:150.3 °C 
  • PSA：63.60000 
  • Density:1.13 g/cm3 
  • LogP:3.33150 
  • Storage Temp.:-20°C 
  • Solubility.:Chloroform (Sparingly), Ethanol (Slightly, Sonicated), Methanol (Slightly) 
  • XLogP3:2.7
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Rotatable Bond Count:4
  • Exact Mass:292.16745924
  • Heavy Atom Count:21
  • Complexity:515
Purity/Quality:

99% *data from raw suppliers

Acetoxyvalerenic acid analytical standard *data from reagent suppliers

Safty Information:
  • Pictogram(s): N 
  • Hazard Codes:N 
  • Statements: 50 
  • Safety Statements: 61 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC1CCC(C2=C(CC(C12)OC(=O)C)C)C=C(C)C(=O)O
  • Isomeric SMILES:C[C@@H]1CC[C@H](C2=C(C[C@H]([C@H]12)OC(=O)C)C)/C=C(\C)/C(=O)O
  • Uses Acetoxyvalerenic Acid (A165400) combined with valerenic acid extracts could be used for treatment and prophylaxis of GABA-related disorders such as anxiety, depression, restlessness and insomnia.
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