Methyl 2-decene-4,6,8-triynoate
Basic information
- CAS
7329-73-9- Standard SMILES
CC#CC#CC#CC=CC(=O)OC- InChIKey
LBAVIXQTLKRIGP-UHFFFAOYSA-N- Molecular formula
- C11H8O2
- Average molar mass
- 172.18 g/mol
- Monoisotopic mass
- 172.05242949
Overview
methyl dec-2-en-4,6,8-triynoate has been reported in Clitocybe truncicola, Artemisia igniaria, and other organisms with data available.
Names & identifiers
- Preferred name
- Methyl 2-decene-4,6,8-triynoate
- IUPAC
- methyl dec-2-en-4,6,8-triynoate
Names & synonyms
methyl 2-decene-4,6,8-triynoate7329-73-9RefChem:157324SCHEMBL4456566DTXSID001303653Methyl dec-2-ene-4,6,8-triynoate
Database identifiers
- CAS
7329-73-9- PubChem CID
- 75958
- DTXSID
DTXSID001303653
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 400
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Related reactions
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Compound notes
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