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114073-58-4 | 1,3-Dodecadiene, 12-(1-ethoxyethoxy)-
CAS No: 114073-58-4 Catalog No: AG000AHO MDL No:
Product Description
Catalog Number:
AG000AHO
Chemical Name:
1,3-Dodecadiene, 12-(1-ethoxyethoxy)-
CAS Number:
114073-58-4
Molecular Formula:
C16H30O2
Molecular Weight:
254.4082
IUPAC Name:
12-(1-ethoxyethoxy)dodeca-1,3-diene
InChI:
InChI=1S/C16H30O2/c1-4-6-7-8-9-10-11-12-13-14-15-18-16(3)17-5-2/h4,6-7,16H,1,5,8-15H2,2-3H3
InChI Key:
HKJDLQZSESCNML-UHFFFAOYSA-N
SMILES:
C=CC=CCCCCCCCCOC(OCC)C
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.225g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.414g/mol
Monoisotopic Mass:
254.225g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
5.5
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