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  • 869-74-9 Structure
  • Basic information

    1. Product Name: 4-(Methylamino)pent-3-en-2-one
    2. Synonyms: 2-Pentanone, 4-(methylimino)- (6CI,7CI,8CI,9CI);4-Methylamino-pent-3-en-2-one
    3. CAS NO:869-74-9
    4. Molecular Formula: C6H11NO
    5. Molecular Weight: 113.16
    6. EINECS: N/A
    7. Product Categories: ACETYLGROUP
    8. Mol File: 869-74-9.mol
    9. Article Data: 2
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 195.003°C at 760 mmHg
    3. Flash Point: 86.043°C
    4. Appearance: /
    5. Density: 0.892g/cm3
    6. Vapor Pressure: 0.429mmHg at 25°C
    7. Refractive Index: 1.439
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 4-(Methylamino)pent-3-en-2-one(CAS DataBase Reference)
    11. NIST Chemistry Reference: 4-(Methylamino)pent-3-en-2-one(869-74-9)
    12. EPA Substance Registry System: 4-(Methylamino)pent-3-en-2-one(869-74-9)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 869-74-9(Hazardous Substances Data)

869-74-9 Usage

Description

4-(Methylamino)pent-3-en-2-one, a chemical compound with the molecular formula C6H11NO, is a ketone and a substituted amine. It features a methylamino group attached to the third carbon of the pent-3-en-2-one chain. Known for its strong odor, this compound is valued for its versatile reactivity and functional group compatibility, making it a key component in the synthesis of various pharmaceuticals and organic compounds. Its potential biological and pharmacological activities have also positioned it as a subject of interest in medicinal chemistry and drug development.

Uses

Used in Pharmaceutical Synthesis:
4-(Methylamino)pent-3-en-2-one is used as a key intermediate in the synthesis of various pharmaceuticals for its versatile reactivity and compatibility with functional groups, contributing to the development of new medications.
Used in Organic Compounds Synthesis:
4-(Methylamino)pent-3-en-2-one serves as a building block in the synthesis of a range of organic compounds, leveraging its reactivity and structural features to create diverse chemical entities.
Used in Fragrance Industry:
4-(Methylamino)pent-3-en-2-one is used as a fragrance ingredient in perfumes and personal care products, capitalizing on its strong odor to enhance the scent profiles of these products.
Used in Medicinal Chemistry and Drug Development:
4-(Methylamino)pent-3-en-2-one is utilized in research for its potential biological and pharmacological activities, making it a valuable asset in the discovery and development of new drugs and therapeutic agents.

Check Digit Verification of cas no

The CAS Registry Mumber 869-74-9 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 8,6 and 9 respectively; the second part has 2 digits, 7 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 869-74:
(5*8)+(4*6)+(3*9)+(2*7)+(1*4)=109
109 % 10 = 9
So 869-74-9 is a valid CAS Registry Number.
InChI:InChI=1/C6H11NO/c1-5(7-3)4-6(2)8/h4,7H,1-3H3

869-74-9SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-(Methylamino)pent-3-en-2-one

1.2 Other means of identification

Product number -
Other names Acetylacetonmethylimid

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:869-74-9 SDS

869-74-9Synthetic route

methylamine
74-89-5

methylamine

acetylacetone
123-54-6

acetylacetone

4-methylamino-pent-3-en-2-one
869-74-9

4-methylamino-pent-3-en-2-one

Conditions
ConditionsYield
In methanol
In tetrahydrofuran
In toluene
4-methylamino-pent-3-en-2-one
869-74-9

4-methylamino-pent-3-en-2-one

(19S,4Z,6E,8S,16E)-13c-acetoxy-13-acetyl-15,6,9c,11t-tetrahydroxy-15t-methoxy-11,2,7,9,4,8r,10t,12t,14c-nonamethyl-11H-18-oxa-2-aza-1(4,9)-furo[3',2':3,4]benzo[1,2-g]indola-cyclooctadecaphane-4,6,16-triene-110,3-dione
21240-38-0

(19S,4Z,6E,8S,16E)-13c-acetoxy-13-acetyl-15,6,9c,11t-tetrahydroxy-15t-methoxy-11,2,7,9,4,8r,10t,12t,14c-nonamethyl-11H-18-oxa-2-aza-1(4,9)-furo[3',2':3,4]benzo[1,2-g]indola-cyclooctadecaphane-4,6,16-triene-110,3-dione

Conditions
ConditionsYield
In methanol for 70h; Ambient temperature;
4-methylamino-pent-3-en-2-one
869-74-9

4-methylamino-pent-3-en-2-one

cobalt(II) chloride
7646-79-9

cobalt(II) chloride

C12H20CoN2O2

C12H20CoN2O2

Conditions
ConditionsYield
With sodium In methanol

869-74-9Relevant articles and documents

Crystal Structures and Characteristics of Hirshfeld Surfaces of Co(II) β-Iminoketonate Derivatives

Dorovskikh,Piryazev,Stabnikov,Morozova

, p. 1052 - 1061 (2019)

A series of Co β-iminoketonate derivatives with the general formula Co(L1)2, (L1 = i-acac (R = H, R1 = R2 = Me) – (1), Mei-acac (R = R1 = R2 = Me) – (2), i-thd (R = H, R1 = R2 = tBu) – (3), Mei-thd (R = Me, R1 = R2 = tBu) – (4)) and Co(L2) (L2= dmpda(acac)2 – (5) are obtained by the reaction of CoCl2 with the sodium salt of the corresponding β-iminoketonate ligand (L1 = R1C(O)CHC(NR)CR2 or L2 = MeC(O)CHC(Me)(NCH2C(Me)2CH2N)C(Me)CHC(O)Me) in methanol. Complexes 1-5 are characterized by the methods of elemental analysis, X-ray diffraction, and IR spectroscopy. The crystal cell parameters at 293 K are as follows: space group Сс, a = 13.7304(9) ?, b = 5.5516(4) ?, с = 18.4034(12) ?, β = 101.964(2)°, V = 1372.34(16) ?3, Z = 4 (2); space group P21/n, a = 9.953(2) ?, b = 12.074(3) ?, с = 11.161(2) ?, β = 109.924(8)°, V = 1260.9(5) ?3, Z = 2 (3); space group P1?, a = 11.7982(7) ?, b = 13.1673(9) ?, с = 17.6159(10) ?, α = 71.493(2)°, β = 83.478(2)°, γ = 72.829(2)°, V = 2478.7(3) ?3, Z = 4 (4); space group Pbca, a = 7.8635(2) ?, b = 14.0521(4) ?, с = 29.8715(9) ?, V = 3300.76(16) ?3, Z = 8 (5). Two pairs of shortened contacts are revealed in molecules 2 and 5 when studying their Hirshfeld surfaces. It is shown with the thermogravimetry method that complexes 1 and 2 are the most volatile in the studied series.

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