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25167-60-6 | Hexadecatriene
CAS No: 25167-60-6 Catalog No: AG002QQM MDL No:
Product Description
Catalog Number:
AG002QQM
Chemical Name:
Hexadecatriene
CAS Number:
25167-60-6
Molecular Formula:
C16H28
Molecular Weight:
220.3935
IUPAC Name:
hexadeca-1,3,5-triene
InChI:
InChI=1S/C16H28/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3,5,7,9,11H,1,4,6,8,10,12-16H2,2H3
InChI Key:
ITGUEXZRKCJJAD-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCC=CC=CC=C
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.219g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.4g/mol
Monoisotopic Mass:
220.219g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
2
XLogP3:
7.5
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