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1-Methyl-4-piperidone

1-Methyl-4-piperidone structure

CAS No:
1445-73-4
Formula:
C6H11NO
Chemical Name:
1-Methyl-4-piperidone
Synonyms:
4-Piperidinone,1-methyl-;4-Piperidone,1-methyl-;1-Methyl-4-piperidinone;1-Methyl-4-piperidone;N-Methyl-4-piperidone;N-Methyl-4-piperidinone;1-Methyl-4-oxopiperidine;NSC 66491;4-Oxo-1-methylpiperidine;2227391-35-5
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

clear yellow to orange liquid

1-Methyl-4-piperidone Basic Attributes

Molecular Weight：

113.16

Exact Mass：

113.16

EC Number：

215-895-5

NSC Number：

66491

DSSTox ID：

DTXSID20162735

HScode：

29333999

Characteristics

PSA：

20.3

XLogP3：

-0.3

Appearance：

clear yellow to orange liquid

Density：

0.973 g/mL at 20 °C(lit.)

Melting Point：

192-193 °C @ Solvent: Ethyl acetate

Boiling Point：

43.5-44.1 °C @ Press: 6 Torr

Flash Point：

140 °F

Refractive Index：

n 20/D 1.460

Water Solubility：

MISCIBLE

Storage Conditions：

0-6ºC

Vapor Pressure：

0.85mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 1224 3/PG 3

wgk germany：

hazard class code：

safety instructions：

23-24/25-37/39-26

Marks：

C,Xi

Stability/Shelf Life：

Stable under normal temperatures and pressures.

Precautionary statement(s)：

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P370+P378, P403+P235, P405, P501

Hazard Statements：

H226

GHS Classification：

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 77 companies from 7 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

1-methyl-4-piperidone

Computed Properties

Molecular Weight:113.16
XLogP3:-0.3
Hydrogen Bond Acceptor Count:2
Exact Mass:113.084063974
Monoisotopic Mass:113.084063974
Topological Polar Surface Area:20.3
Heavy Atom Count:8
Complexity:90.7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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