6-Methyl-5-hepten-2-one CAS 110-93-0 C8H14O

6-Methyl-5-hepten-2-one Basic information

Product Name:

6-Methyl-5-hepten-2-one

CAS:

110-93-0

MF:

C8H14O

MW:

126.2

EINECS:

203-816-7

Mol File:

110-93-0.mol

6-Methyl-5-hepten-2-one Chemical Properties

Melting point

-67.1 °C

Boiling point

73 °C18 mm Hg(lit.)

density

0.855 g/mL at 25 °C(lit.)

vapor pressure

1.121hPa at 20℃

refractive index

n20/D 1.439(lit.)

FEMA

2707 | 6-METHYL-5-HEPTEN-2-ONE

Fp

123 °F

storage temp.

Sealed in dry,2-8°C

solubility

Soluble in methanol and chloroform.

form

Liquid

color

Colorless to Light yellow

Specific Gravity

0.855

PH

6.6 (3g/l, H2O, 25℃)

Odor

at 10.00 % in dipropylene glycol. citrus green musty lemongrass apple

Odor Type

citrus

biological source

synthetic

explosive limit

1.1-7.3%(V)

Water Solubility

insoluble

JECFA Number

1120

BRN

1741705

Henry’s Law Constant

1.2×10-1 mol/(m3Pa) at 25℃, Wu et al. (2022)

Major Application

flavors and fragrances

Cosmetics Ingredients Functions

PERFUMING

InChI

1S/C8H14O/c1-7(2)5-4-6-8(3)9/h5H,4,6H2,1-3H3

InChIKey

UHEPJGULSIKKTP-UHFFFAOYSA-N

SMILES

C\C(C)=C\CCC(C)=O

LogP

2.07 at 25℃

CAS DataBase Reference

110-93-0(CAS DataBase Reference)

NIST Chemistry Reference

5-Hepten-2-one, 6-methyl-(110-93-0)

EPA Substance Registry System

6-Methyl-5-hepten-2-one (110-93-0)