Matricaria ester

Base Information

• Chemical Name: Matricaria ester
• CAS No.: 505-02-2
• Molecular Formula: C11H10O2
• Molecular Weight: 174.19600
• DSSTox Substance ID: DTXSID10876298
• Nikkaji Number: J1.106.439F,J1.605.018K,J14.351K,J16.463A
• Wikidata: Q82857911
• Mol file: 505-02-2.mol

Synonyms:Matricaria ester;505-02-2;2(E),8(E)-Matricaria ester;SCHEMBL16685623;DTXSID10876298;GXPDZHWFJLUFGY-SCPMJEMWSA-N;2,8-Decadiene-4,6-diynoic acid methyl ester;2,8-Decadiene-4,6-diynoic acid, methyl ester;(2E,8E)-2,8-Decadiene-4,6-diynoic acid methyl ester

Chemical Property of Matricaria ester

Chemical Property:

• PSA: 26.30000
• LogP: 1.29850
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 174.068079557
• Heavy Atom Count: 13
• Complexity: 347

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=CC#CC#CC=CC(=O)OC
• Isomeric SMILES: C/C=C/C#CC#C/C=C/C(=O)OC

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