Methyl tetradec-5-ynoate
Basic information
- CAS
39077-29-7- Standard SMILES
CCCCCCCCC#CCCCC(=O)OC- InChIKey
LZGVSHAOWJOSKI-UHFFFAOYSA-N- Molecular formula
- C15H26O2
- Average molar mass
- 238.37 g/mol
- Monoisotopic mass
- 238.19328007
Names & identifiers
- Preferred name
- Methyl tetradec-5-ynoate
- IUPAC
- methyl tetradec-5-ynoate
- English name
- Methyl tetradec-5-ynoate
- Molecular formula
- C15H26O2
- Molecular weight
- 238.37
Names & synonyms
Methyl tetradec-5-ynoate39077-29-7DTXSID80339527RefChem:356870DTXCID20290608LZGVSHAOWJOSKI-UHFFFAOYSA-NMethyl 5-tetradecynoateMethyl 5-tetradecynoate #5-Tetradecynoic acid, methyl ester
Database identifiers
- CAS
39077-29-7- PubChem CID
- 556809
- DTXSID
DTXSID80339527- Nikkaji
- J530.328A
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 244
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Related reactions
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Compound notes
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