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88486-38-8

88486-38-8 | 2(5H)-Furanone, 3-hexyl-5-(2-phenylethyl)-

CAS No: 88486-38-8 Catalog No: AG0049VX MDL No:

Product Description

Catalog Number:
AG0049VX
Chemical Name:
2(5H)-Furanone, 3-hexyl-5-(2-phenylethyl)-
CAS Number:
88486-38-8
Molecular Formula:
C18H24O2
Molecular Weight:
272.3820
IUPAC Name:
4-hexyl-2-(2-phenylethyl)-2H-furan-5-one
InChI:
InChI=1S/C18H24O2/c1-2-3-4-8-11-16-14-17(20-18(16)19)13-12-15-9-6-5-7-10-15/h5-7,9-10,14,17H,2-4,8,11-13H2,1H3
InChI Key:
HMLKWFVFRYFHCG-UHFFFAOYSA-N
SMILES:
CCCCCCC1=CC(OC1=O)CCc1ccccc1

Properties

Complexity:
326  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.178g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.388g/mol
Monoisotopic Mass:
272.178g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5  

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