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188746-65-8 | 1,7-Dodecadiene
CAS No: 188746-65-8 Catalog No: AG002H9G MDL No:
Product Description
Catalog Number:
AG002H9G
Chemical Name:
1,7-Dodecadiene
CAS Number:
188746-65-8
Molecular Formula:
C12H22
Molecular Weight:
166.3031
IUPAC Name:
dodeca-1,7-diene
InChI:
InChI=1S/C12H22/c1-3-5-7-9-11-12-10-8-6-4-2/h3,10,12H,1,4-9,11H2,2H3
InChI Key:
SUDSRNZNIPQKNC-UHFFFAOYSA-N
SMILES:
CCCCC=CCCCCC=C
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.172g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.308g/mol
Monoisotopic Mass:
166.172g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.3
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