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Structure

1,5,9-Trimethyl-13-oxabicyclo[10.1.0]trideca-4,8-diene

CAS
71735-79-0
Catalog Number
ACM71735790
Category
Other Products
Molecular Weight
220.35
Molecular Formula
C15H24O

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Specification

Synonyms
Trimethylcyclododeca-5,9-diene-1,2-epoxide
IUPAC Name
(4Z,8Z)-1,2,2-Trimethyl-13-oxabicyclo[10.1.0]trideca-4,8-diene
Canonical SMILES
CC1(CC=CCCC=CCCC2C1(O2)C)C
InChI
InChI=1S/C15H24O/c1-14(2)12-10-8-6-4-5-7-9-11-13-15(14,3)16-13/h5,7-8,10,13H,4,6,9,11-12H2,1-3H3/b7-5-,10-8-
InChI Key
PUXIGTZUWRBNMW-RRMOSLQNSA-N
Flash Point
>100 °C
Density
0.969-0.979 g/mL at 25 °C(lit.)
Solubility
water, 0.6874 mg/L @ 25 °C (est)
Assay
0.98
EC Number
275-967-7
Exact Mass
220.182715385
Isomeric SMILES
CC1(C/C=C\CC/C=C\CCC2C1(O2)C)C
Monoisotopic Mass
220.182715385
Packaging
100 g
Refractive Index
n20/D 1.504-1.508(lit.)
Topological Polar Surface Area
12.5 Ų
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