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14959-86-5 | 7-Dodecen-1-ol, acetate, (7Z)-
CAS No: 14959-86-5 Catalog No: AG001LV5 MDL No:
Product Description
Catalog Number:
AG001LV5
Chemical Name:
7-Dodecen-1-ol, acetate, (7Z)-
CAS Number:
14959-86-5
Molecular Formula:
C14H26O2
Molecular Weight:
226.3550
IUPAC Name:
[(Z)-dodec-7-enyl] acetate
InChI:
InChI=1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14(2)15/h6-7H,3-5,8-13H2,1-2H3/b7-6-
InChI Key:
MUZGQHWTRUVFLG-SREVYHEPSA-N
SMILES:
CCCC/C=C\CCCCCCOC(=O)C
EC Number:
239-031-1
UNII:
83U0A15960
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
226.193g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.36g/mol
Monoisotopic Mass:
226.193g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
Literature
| Title | Journal |
|---|---|
| Pheromone unwrapping by pH flip-flopping. | Chemistry & biology 20040801 |
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