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87877-77-8 | 5-(1-Hydroxyhexyl)dihydro-2(3H)-furanone
CAS No: 87877-77-8 Catalog No: AG003AGH MDL No:
Product Description
Catalog Number:
AG003AGH
Chemical Name:
5-(1-Hydroxyhexyl)dihydro-2(3H)-furanone
CAS Number:
87877-77-8
Molecular Formula:
C10H18O3
Molecular Weight:
186.2481
IUPAC Name:
5-(1-hydroxyhexyl)oxolan-2-one
InChI:
InChI=1S/C10H18O3/c1-2-3-4-5-8(11)9-6-7-10(12)13-9/h8-9,11H,2-7H2,1H3
InChI Key:
WPWMAIDTZPLUGB-UHFFFAOYSA-N
SMILES:
CCCCCC(C1CCC(=O)O1)O
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.251g/mol
Monoisotopic Mass:
186.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Mechanism and behavioral context of male sex pheromone release in Nasonia vitripennis. | Journal of chemical ecology 20090401 |
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