Cas no 81759-25-3 (Di(pyrrolidin-1-yl)methanone)

Di(pyrrolidin-1-yl)methanone structure
Di(pyrrolidin-1-yl)methanone structure
Product Name:Di(pyrrolidin-1-yl)methanone
CAS No:81759-25-3
MF:C9H16N2O
MW:168.236142158508
MDL:MFCD00216641
CID:60370
PubChem ID:736440
Update Time:2024-10-27

Di(pyrrolidin-1-yl)methanone Chemical and Physical Properties

Names and Identifiers

    • Di(pyrrolidin-1-yl)methanone
    • 1,1'-Carbonyldipyrrolidine
    • Bis(tetramethylen)urea
    • dipyrrolidin-1-ylmethanone
    • CDP
    • Pyrrolidine,1,1'-carbonylbis- (9CI)
    • Pyrrolidine, 1,1'-carbonyldi- (6CI)
    • Bistetramethyleneurea
    • carbonyl dipyrrolidine
    • AM83814
    • C93512
    • ditetrahydro-1H-pyrrol-1-ylmethanone
    • AKOS015909530
    • 81759-25-3
    • 1-(pyrrolidine-1-carbonyl)pyrrolidine
    • Pyrrolidine, 1,1'-carbonylbis-
    • MFCD00216641
    • SCHEMBL413020
    • CDP ?1,1'-Carbonyldipyrrolidine
    • A840191
    • carbonyldipyrrolidine
    • FT-0653788
    • J-503729
    • CS-0322403
    • 1,1-Carbonyldipyrrolidine
    • AC-24865
    • DTXSID20353025
    • AS-17511
    • Di-1-pyrrolidinylmethanone (ACI)
    • Pyrrolidine, 1,1′-carbonylbis- (9CI)
    • Pyrrolidine, 1,1′-carbonyldi- (6CI)
    • 1,1′-Carbonyldipyrrolidine
    • 1,1''-Carbonyldipyrrolidine
    • DB-018689
    • MDL: MFCD00216641
    • Inchi: 1S/C9H16N2O/c12-9(10-5-1-2-6-10)11-7-3-4-8-11/h1-8H2
    • InChI Key: HPTQKSXAQBHFKL-UHFFFAOYSA-N
    • SMILES: O=C(N1CCCC1)N1CCCC1

Computed Properties

  • Exact Mass: 168.12600
  • Monoisotopic Mass: 168.126263138g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 151
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.7
  • Topological Polar Surface Area: 23.6?2

Experimental Properties

  • Color/Form: No data available
  • Density: 1.086
  • Melting Point: No data available
  • Boiling Point: 148-150℃
  • Flash Point: 113 oC
  • Refractive Index: 1.513
  • Water Partition Coefficient: Slightly soluble in water.
  • PSA: 23.55000
  • LogP: 1.17380
  • Sensitiveness: Light Sensitive

Di(pyrrolidin-1-yl)methanone Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Di(pyrrolidin-1-yl)methanone Pricemore >>

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Di(pyrrolidin-1-yl)methanone Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Selenium ;  2 h, 0.1 MPa, 20 °C
1.2 Reagents: Oxygen ;  1 h, 0.1 MPa, 20 °C
Reference
Efficient solvent-free synthesis of urea derivatives using selenium-catalyzed carbonylation of amines with carbon monoxide and oxygen
Mizuno, Takumi; Nakai, Takeo; Mihara, Masatoshi, Synthesis, 2010, (24), 4251-4255

Production Method 2

Reaction Conditions
1.1 Reagents: Triethylamine Solvents: Dichloromethane ;  12 h, rt
Reference
Iridium-Catalyzed Enantioselective α-C(sp3)-H Borylation of Azacycles
Chen, Lili; Yang, Yuhuan; Liu, Luhua; Gao, Qian; Xu, Senmiao, Journal of the American Chemical Society, 2020, 142(28), 12062-12068

Production Method 3

Reaction Conditions
1.1 Reagents: Oxygen Catalysts: 2242829-68-9 Solvents: Toluene ;  30 h, 1.6 MPa, 60 °C
Reference
Amine-Responsive Disassembly of AuI-CuI Double Salts for Oxidative Carbonylation
Cao, Yanwei; Yang, Jian-Gong; Deng, Yi; Wang, Shengchun; Liu, Qi; et al, Angewandte Chemie, 2020, 59(5), 2080-2084

Production Method 4

Reaction Conditions
1.1 Reagents: Potassium carbonate ,  Iodine Catalysts: Tungsten hexacarbonyl Solvents: Dichloromethane
Reference
Catalytic oxidative carbonylation of aliphatic secondary amines to tetrasubstituted ureas
McCusker, J. E.; Qian, F.; McElwee-White, L., Journal of Molecular Catalysis A: Chemical, 2000, 159(1), 11-17

Production Method 5

Reaction Conditions
1.1 Reagents: Triethylamine Solvents: Dichloromethane ;  24 h, rt
Reference
Achieving functional group diversity in parallel synthesis: solution-phase synthesis of a library of ureas, carbamates, thiocarbamates, and amides using carbamoylimidazolium salts
Grzyb, Justyna A.; Batey, Robert A., Tetrahedron Letters, 2008, 49(36), 5279-5282

Production Method 6

Reaction Conditions
1.1 Solvents: 1,4-Dioxane ;  20 - 30 min, rt
1.2 Reagents: Trichloroisocyanuric acid ,  Triphenylphosphine Solvents: 1,4-Dioxane ;  0 °C; 5.5 h, 0 °C → 80 °C
Reference
A high-yielding, expeditious, and multicomponent synthesis of urea and carbamate derivatives by using triphenylphosphine/trichloroisocyanuric acid system
Ghodsinia, Sara S. E.; Akhlaghinia, Batool, Phosphorus, 2016, 191(1), 1-7

Production Method 7

Reaction Conditions
1.1 Solvents: Dimethyl sulfoxide ;  30 min, rt
1.2 Reagents: Triphenylphosphine ,  Diethyl azodicarboxylate ;  rt
1.3 4 h, rt
Reference
A high yielding, one-pot synthesis of substituted ureas from the corresponding amines using Mitsunobu's reagent
Chaturvedi, Devdutt; Mishra, Nisha; Mishra, Virendra, Monatshefte fuer Chemie, 2008, 139(3), 267-270

Production Method 8

Reaction Conditions
1.1 Reagents: Triethylamine Solvents: Tetrahydrofuran
Reference
Synthetic studies towards ristocetin A and related compounds using arene-ruthenium chemistry
Lee, Kieseung, 1996, , 56(11),

Di(pyrrolidin-1-yl)methanone Raw materials

Di(pyrrolidin-1-yl)methanone Preparation Products

Di(pyrrolidin-1-yl)methanone Suppliers

Amadis Chemical Company Limited
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(CAS:81759-25-3)Di(pyrrolidin-1-yl)methanone
Order Number:A840191
Stock Status:in Stock
Quantity:100g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 06:48
Price ($):164.0
Tiancheng Chemical (Jiangsu) Co., Ltd
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(CAS:81759-25-3)1,1'-羰基二吡咯烷
Order Number:LE26660530
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:57
Price ($):discuss personally

Di(pyrrolidin-1-yl)methanone Related Literature

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Amadis Chemical Company Limited
(CAS:81759-25-3)Di(pyrrolidin-1-yl)methanone
A840191
Purity:99%
Quantity:100g
Price ($):164.0
Email
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:81759-25-3)1,1'-羰基二吡咯烷
LE26660530
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
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