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138655-05-7 | 2,6-Octadecadienal, 3,7-dimethyl-
CAS No: 138655-05-7 Catalog No: AG0018Y5 MDL No:
Product Description
Catalog Number:
AG0018Y5
Chemical Name:
2,6-Octadecadienal, 3,7-dimethyl-
CAS Number:
138655-05-7
Molecular Formula:
C20H36O
Molecular Weight:
292.4992
IUPAC Name:
3,7-dimethyloctadeca-2,6-dienal
InChI:
InChI=1S/C20H36O/c1-4-5-6-7-8-9-10-11-12-14-19(2)15-13-16-20(3)17-18-21/h15,17-18H,4-14,16H2,1-3H3
InChI Key:
GWTSZDCNXARJGP-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC(=CCCC(=CC=O)C)C
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.277g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.507g/mol
Monoisotopic Mass:
292.277g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
8.3
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