Cas no 6739-80-6 (4-(2-Oxopyrrolidin-1-yl)butanoic acid)

4-(2-Oxopyrrolidin-1-yl)butanoic acid structure
6739-80-6 structure
Product Name:4-(2-Oxopyrrolidin-1-yl)butanoic acid
CAS No:6739-80-6
MF:C8H13NO3
MW:171.193722486496
MDL:MFCD05237227
CID:1067620
PubChem ID:329775518
Update Time:2025-04-20

4-(2-Oxopyrrolidin-1-yl)butanoic acid Chemical and Physical Properties

Names and Identifiers

    • 4-(2-Oxopyrrolidin-1-yl)butanoic acid
    • 4-(2-Oxo-pyrrolidin-1-yl)-butyric acid
    • 4-(2-oxo-1-pyrrolidinyl)butanoic acid
    • 4-(2-oxopyrrolidin-1-yl)butanoic acid(SALTDATA: FREE)
    • 4-(2-Oxo-pyrrolidino)-buttersaeure
    • 4-(2-oxo-pyrrolidino)-butyric acid
    • 4-(2-oxopyrrolidinyl)butanoic acid
    • 4-(2-oxopyrrolidinyl)butyric acid
    • BB_SC-3707
    • 6739-80-6
    • 4-(2-oxopyrrolidin-1-yl)butanoicacid
    • 4-(2-Oxopyrrolidin-1-yl)butanoic acid, AldrichCPR
    • 4-(2-oxo-pyrrolidin-1-yl)butyric acid
    • MFCD05237227
    • TS-00152
    • FT-0677236
    • CS-0312611
    • 4-(2-OXO-PYRROLIDIN-1-YL)-BUTYRICACID
    • BB 0240557
    • SCHEMBL855306
    • DTXSID40389846
    • HMS1693K21
    • 4_2_oxopyrrolidin_1_yl_butanoic_acid
    • AKOS000139776
    • STK500382
    • DA-18492
    • ALBB-000120
    • BBL010141
    • MDL: MFCD05237227
    • Inchi: 1S/C8H13NO3/c10-7-3-1-5-9(7)6-2-4-8(11)12/h1-6H2,(H,11,12)
    • InChI Key: WRDMYTORSDPYMO-UHFFFAOYSA-N
    • SMILES: O=C1CCCN1CCCC(=O)O

Computed Properties

  • Exact Mass: 171.09000
  • Monoisotopic Mass: 171.09
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 4
  • Complexity: 191
  • 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
  • Topological Polar Surface Area: 57.6A^2
  • XLogP3: -0.4

Experimental Properties

  • Density: 1.209
  • Melting Point: Not available
  • Boiling Point: 402.6°C at 760 mmHg
  • Flash Point: 197.3°C
  • Refractive Index: 1.509
  • PSA: 57.61000
  • LogP: 0.41150
  • Vapor Pressure: 0.0±2.0 mmHg at 25°C

4-(2-Oxopyrrolidin-1-yl)butanoic acid Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H319
  • Warning Statement: P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Safety Instruction: H303+H313+H333
  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT
  • Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)

4-(2-Oxopyrrolidin-1-yl)butanoic acid Customs Data

  • HS CODE:2933790090
  • Customs Data:

    China Customs Code:

    2933790090

    Overview:

    2933790090 Other lactams. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:9.0% 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:

    2933790090. other lactams. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:9.0%. General tariff:20.0%

4-(2-Oxopyrrolidin-1-yl)butanoic acid Pricemore >>

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