Catalog Number |
ACM105700876-3 |
CAS |
105700-87-6 |
Structure |
|
IUPAC Name |
acetic acid;tetradeca-4,10-dien-1-ol |
Synonyms |
105700-87-6;4,10-Tetradecadien-1-ol, acetate, (E,Z)-;ACMC-20m8t7;DTXSID70761959;Acetic acid--tetradeca-4,10-dien-1-ol (1/1) |
Molecular Weight |
270.41g/mol |
Molecular Formula |
C16H30O3 |
Canonical SMILES |
CCCC=CCCCCC=CCCCO.CC(=O)O |
InChI |
InChI=1S/C14H26O.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15;1-2(3)4/h4-5,10-11,15H,2-3,6-9,12-14H2,1H3;1H3,(H,3,4) |
InChI Key |
VTWSJJVEFWOBML-UHFFFAOYSA-N |
Complexity |
190 |
Covalently-Bonded Unit Count |
2 |
Exact Mass |
270.21949481g/mol |
Heavy Atom Count |
19 |
Hydrogen Bond Acceptor Count |
3 |
Monoisotopic Mass |
270.21949481g/mol |
Rotatable Bond Count |
10 |
Topological Polar Surface Area |
57.5Ų |