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Home > Encyclopedia > 1,3-Dimethyl-4-piperidone

1,3-Dimethyl-4-piperidone

1,3-Dimethyl-4-piperidone structure

1,3-Dimethyl-4-piperidone 

structure
  • CAS No:

    4629-80-5

  • Formula:

    C7H13NO

  • Chemical Name:

    1,3-Dimethyl-4-piperidone

  • Synonyms:

    4-Piperidinone,1,3-dimethyl-;4-Piperidone,1,3-dimethyl-;1,3-Dimethyl-4-piperidinone;1,3-Dimethyl-4-piperidone;123004-50-2

  • Categories:

    Pharmaceutical Intermediates  >  Gastrointestinal Agents

Description

Colorless liquid

1,3-Dimethyl-4-piperidone Basic Attributes

127.18

127.18

225-046-0

2933399090

Characteristics

20.3

0.3

colourless or slightly yellow liquid

0.9±0.1 g/cm3

159-160 °C(lit.)

43.0-43.4 °C @ Press: 5.5 Torr

64.5±10.0 °C

1.452

Safety Information

III

6.1(b)

UN 3146 6.1/PG 3

3

37/38-41-43

26-36/37-39

WH6705000

Xi

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.

1,3-Dimethyl-4-piperidone Use and Manufacturing

Methods of Manufacturing

Add β-methylaminoisobutyrate methyl ester and methyl acrylate to obtain N-(2-methoxycarbonylethyl)-N-(2-methoxycarbonylisopropyl)methylamine, the latter in sodium metal Participate in the lower cyclization, then hydrolyze with hydrochloric acid, and then eliminate to get this product.

Uses

Anadal intermediate.

Computed Properties

Molecular Weight:127.18
XLogP3:0.3
Hydrogen Bond Acceptor Count:2
Exact Mass:127.099714038
Monoisotopic Mass:127.099714038
Topological Polar Surface Area:20.3
Heavy Atom Count:9
Complexity:122
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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