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141868-17-9 | 2,6,10-Tridecatriene, 13-iodo-2,6,10-trimethyl-
CAS No: 141868-17-9 Catalog No: AG001HA6 MDL No:
Product Description
Catalog Number:
AG001HA6
Chemical Name:
2,6,10-Tridecatriene, 13-iodo-2,6,10-trimethyl-
CAS Number:
141868-17-9
Molecular Formula:
C16H27I
Molecular Weight:
346.2901
IUPAC Name:
13-iodo-2,6,10-trimethyltrideca-2,6,10-triene
InChI:
InChI=1S/C16H27I/c1-14(2)8-5-9-15(3)10-6-11-16(4)12-7-13-17/h8,10,12H,5-7,9,11,13H2,1-4H3
InChI Key:
DZUVOVCKRFBPCE-UHFFFAOYSA-N
SMILES:
ICCC=C(CCC=C(CCC=C(C)C)C)C
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.116g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
346.296g/mol
Monoisotopic Mass:
346.116g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
7.2
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