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74063-65-3 | 2,6-Octadienal, 7-methyl-, (E)-
CAS No: 74063-65-3 Catalog No: AG0059RR MDL No:
Product Description
Catalog Number:
AG0059RR
Chemical Name:
2,6-Octadienal, 7-methyl-, (E)-
CAS Number:
74063-65-3
Molecular Formula:
C9H14O
Molecular Weight:
138.2069
IUPAC Name:
7-methylocta-2,6-dienal
InChI:
InChI=1S/C9H14O/c1-9(2)7-5-3-4-6-8-10/h4,6-8H,3,5H2,1-2H3
InChI Key:
DAYOEEGKLUCJMX-UHFFFAOYSA-N
SMILES:
O=C/C=C/CCC=C(C)C
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.104g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.21g/mol
Monoisotopic Mass:
138.104g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.4
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