Home Other Building Blocks ACETIC ACID 5-HEXEN-1-YL ESTER

ACETIC ACID 5-HEXEN-1-YL ESTER

CAS No.:
5048-26-0
Catalog Number:
AG003NMQ
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG003NMQ
Chemical Name:
ACETIC ACID 5-HEXEN-1-YL ESTER
CAS Number:
5048-26-0
MDL Number:
MFCD00060856
IUPAC Name:
hex-5-enyl acetate
InChI:
InChI=1S/C8H14O2/c1-3-4-5-6-7-10-8(2)9/h3H,1,4-7H2,2H3
InChI Key:
MPLWNENKBSBMFN-UHFFFAOYSA-N
Properties
Complexity:
108  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.099g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.198g/mol
Monoisotopic Mass:
142.099g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
Defense-inducing volatiles: in search of the active motif. Journal of chemical ecology 20080501
Properties