8,9-Didehydro-7-hydroxydolichodial

Base Information

• Chemical Name: 8,9-Didehydro-7-hydroxydolichodial
• CAS No.: 97856-19-4
• Molecular Formula: C10H12O3
• Molecular Weight: 180.2005
• DSSTox Substance ID: DTXSID20243290
• Wikidata: Q76155959
• Mol file: 97856-19-4.mol

Synonyms:8,9-Didehydro-7-hydroxydolichodial;97856-19-4;(3S,5R)-3-hydroxy-2-methyl-5-(3-oxoprop-1-en-2-yl)cyclopentene-1-carbaldehyde;(1R-trans)-2-Formyl-4-hydroxy-3-methyl-alpha-methylene-2-cyclopentene-1-acetaldehyde;2-Cyclopentene-1-acetaldehyde, 2-formyl-4-hydroxy-3-methyl-alpha-methylene-, (1R-trans)-;DTXSID20243290;HPPDWCXQOXACSB-SCZZXKLOSA-N;AKOS032949055;LS-58286;2-Cyclopentene-1-acetaldehyde, 2-formyl-4-hydroxy-3-methyl--methylene-, (1R-trans)-

Chemical Property of 8,9-Didehydro-7-hydroxydolichodial

Chemical Property:

• Vapor Pressure: 1.37E-06mmHg at 25°C
• Boiling Point: 358.7°C at 760 mmHg
• Flash Point: 185°C
• PSA: 54.37000
• Density: 1.247g/cm³
• LogP: 0.63770
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 180.078644241
• Heavy Atom Count: 13
• Complexity: 289

Purity/Quality:

99% ^*data from raw suppliers

8,9-Didehydro-7-hydroxydolichodial 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(CC1O)C(=C)C=O)C=O
• Isomeric SMILES: CC1=C([C@H](C[C@@H]1O)C(=C)C=O)C=O