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207238-19-5 | 1,6-Octadiene, 8-(pentyloxy)-
CAS No: 207238-19-5 Catalog No: AG002IWS MDL No:
Product Description
Catalog Number:
AG002IWS
Chemical Name:
1,6-Octadiene, 8-(pentyloxy)-
CAS Number:
207238-19-5
Molecular Formula:
C13H24O
Molecular Weight:
196.3291
IUPAC Name:
8-pentoxyocta-1,6-diene
InChI:
InChI=1S/C13H24O/c1-3-5-7-8-9-11-13-14-12-10-6-4-2/h3,9,11H,1,4-8,10,12-13H2,2H3
InChI Key:
VTANVKHLENPEHP-UHFFFAOYSA-N
SMILES:
CCCCCOCC=CCCCC=C
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.183g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.334g/mol
Monoisotopic Mass:
196.183g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.3
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