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2-Ethyl-5-methylfuran

2-Ethyl-5-methylfuran structure

CAS No:
1703-52-2
Formula:
C7H10O
Chemical Name:
2-Ethyl-5-methylfuran
Synonyms:
Furan,2-ethyl-5-methyl-;2-Ethyl-5-methylfuran;2-Methyl-5-ethylfuran;5-Methyl-2-ethylfuran

Description

2-ethyl-5-methylfuran is a member of the class of furans that is furan in which the hydrogens at positions 2 and 5 are replaced by ethyl and methyl groups, respectively. It has a role as a flavouring agent, a human urinary metabolite, a plant metabolite, a fungal metabolite and a mouse metabolite.

2-Ethyl-5-methylfuran Basic Attributes

Molecular Weight：

110.15

Exact Mass：

110.15

EC Number：

216-937-5

UNII：

PG4BLD3EJI

DSSTox ID：

DTXSID80168839

HScode：

2932190090

Characteristics

PSA：

13.14000

XLogP3：

2.15040

Density：

0.8883 g/cm³ @ Temp: 20 °C

Boiling Point：

118.5 °C

Flash Point：

7 °C

Refractive Index：

n20/D 1.447(lit.)

Water Solubility：

329.7 mg/L @ 25 °C (est)

Safety Information

Packing level：

Hazard category：

3.1

Transport codes：

1993

hazard class code：

11-20/21/22

safety instructions：

16-36

Marks：

F,Xn

2-Ethyl-5-methylfuran Use and Manufacturing

Use Classification：

Food additives -> Flavoring Agents

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:110.15
XLogP3:2.2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:110.073164938
Monoisotopic Mass:110.073164938
Topological Polar Surface Area:13.1
Heavy Atom Count:8
Complexity:70.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Ethyl-5-methylfuran

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties

2-Ethyl-5-methylfuran

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