2-Hexylfuran
-
2-Hexylfuran
structure -
-
CAS No:
3777-70-6
-
Formula:
C10H16O
-
Chemical Name:
2-Hexylfuran
-
Synonyms:
Furan,2-hexyl-;2-Hexylfuran
-
CAS No:
Description
2-hexylfuran is a member of the class of furans that is furan in which the hydrogen at position 2 is replaced by a hexyl group. It has a role as a flavouring agent, a mammalian metabolite, a human metabolite and a volatile oil component.
Characteristics
13.1
3.40240
0.9014 g/cm3 @ Temp: 20 °C
76-78 °C @ Press: 15 Torr
60.8ºC
1.457
13.87 mg/L @ 25 °C (est)
Safety Information
III
UN1993
P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P303+P361+P353, P330, P370+P378, P403+P235, P501
H226
|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P303+P361+P353, P330, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 5 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:152.23
XLogP3:4.2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:152.120115130
Monoisotopic Mass:152.120115130
Topological Polar Surface Area:13.1
Heavy Atom Count:11
Complexity:90.9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
