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Home > Encyclopedia > 3-Methyl-2-cyclopenten-1-one

3-Methyl-2-cyclopenten-1-one

3-Methyl-2-cyclopenten-1-one structure

3-Methyl-2-cyclopenten-1-one 

structure
  • CAS No:

    2758-18-1

  • Formula:

    C6H8O

  • Chemical Name:

    3-Methyl-2-cyclopenten-1-one

  • Synonyms:

    2-Cyclopenten-1-one,3-methyl-;3-Methyl-2-cyclopenten-1-one;3-Methyl-2-cyclopentenone;3-Methyl-2-cyclopentene-1-one;Nussol;3-Methylcyclopenten-2-one

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

3-Methyl-2-cyclopenten-1-one is an endogenous metabolite.


Pale straw-coloured liquid; warm-spicy, sweet-floral and diffusive yet quite tenaceous odour


3-Methyl-2-cyclopenten-1-one is a cyclic ketone.

3-Methyl-2-cyclopenten-1-one Basic Attributes

96.129

96.13

220-421-5

6V7RSW7273

DTXSID1062629

2914299000

Characteristics

17.1

0.5

Pale straw-coloured liquid; warm-spicy, sweet-floral and diffusive yet quite tenaceous odour

0.9467 g/cm3 @ Temp: 15 °C

76-77 °C

157.5 °C

53.1±9.8 °C

1.482

Micible with water.

Refrigerator (+4ºC)

2.74mmHg at 25°C

Safety Information

III

1224

3

R36/38

S24/25

Stable under normal temperatures and pressures.

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

3-Methyl-2-cyclopenten-1-one Use and Manufacturing

Uses

Flavoring Agents -> JECFA Flavorings Index

2-Cyclopenten-1-one, 3-methyl-: ACTIVE

Food additives -> Flavoring Agents

Flavoring Agents

Computed Properties

Molecular Weight:96.13
XLogP3:0.5
Hydrogen Bond Acceptor Count:1
Exact Mass:96.057514874
Monoisotopic Mass:96.057514874
Topological Polar Surface Area:17.1
Heavy Atom Count:7
Complexity:122
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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