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89374-89-0

89374-89-0 | 2,5-Decadien-4-one, 6-methyl-, (E,Z)-

CAS No: 89374-89-0 Catalog No: AG003WFY MDL No:

Product Description

Catalog Number:
AG003WFY
Chemical Name:
2,5-Decadien-4-one, 6-methyl-, (E,Z)-
CAS Number:
89374-89-0
Molecular Formula:
C11H18O
Molecular Weight:
166.2600
IUPAC Name:
6-methyldeca-2,5-dien-4-one
InChI:
InChI=1S/C11H18O/c1-4-6-8-10(3)9-11(12)7-5-2/h5,7,9H,4,6,8H2,1-3H3
InChI Key:
DFZOIEAHZGLEBT-UHFFFAOYSA-N
SMILES:
CCCC/C(=C\C(=O)/C=C/C)/C

Properties

Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.136g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.264g/mol
Monoisotopic Mass:
166.136g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2  
XLogP3:
3.7  

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