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15786-37-5 | 4,8-Dodecadienedial, (E,Z)- (8CI,9CI)
CAS No: 15786-37-5 Catalog No: AG001PS6 MDL No:
Product Description
Catalog Number:
AG001PS6
Chemical Name:
4,8-Dodecadienedial, (E,Z)- (8CI,9CI)
CAS Number:
15786-37-5
Molecular Formula:
C12H18O2
Molecular Weight:
194.2701
IUPAC Name:
dodeca-4,8-dienedial
InChI:
InChI=1S/C12H18O2/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h3-6,11-12H,1-2,7-10H2
InChI Key:
CIGZZLYQLQLUQO-UHFFFAOYSA-N
SMILES:
O=CCC/C=C\CC/C=C/CCC=O
EC Number:
239-885-5
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.274g/mol
Monoisotopic Mass:
194.131g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
1.6
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