Cas no 30000-61-4 (4-(1H-pyrrol-3-yl)butanoic acid)

4-(1H-pyrrol-3-yl)butanoic acid structure
30000-61-4 structure
Product Name:4-(1H-pyrrol-3-yl)butanoic acid
CAS No:30000-61-4
MF:C8H11NO2
MW:153.178442239761
CID:296938
PubChem ID:255668
Update Time:2025-04-19

4-(1H-pyrrol-3-yl)butanoic acid Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrrole-3-butanoicacid
    • 4-(1H-pyrrol-3-yl)butanoic acid
    • 4-(3-Pyrrolyl)butyric acid
    • PYRROLE-3-BUTYRIC ACID
    • 1H-pyrrole-3-butyric acid
    • 4-(1H-pyrrol-3-yl)-butyric acid
    • 4-(3-pyrrolyl)butanoic acid
    • 4-<Pyrrolyl(3')>-buttersaeure
    • SCHEMBL1278387
    • 4-(3-Pyrrolyl)butyric acid, 95%
    • (PYRROLYL-3)-4 BUTANOIC ACID
    • EN300-1837812
    • FT-0703586
    • CS-0433610
    • DTXSID80292289
    • J-017732
    • 30000-61-4
    • G88812
    • ZILGRACWFSKIFU-UHFFFAOYSA-N
    • MDL: MFCD07438025
    • Inchi: 1S/C8H11NO2/c10-8(11)3-1-2-7-4-5-9-6-7/h4-6,9H,1-3H2,(H,10,11)
    • InChI Key: ZILGRACWFSKIFU-UHFFFAOYSA-N
    • SMILES: OC(CCCC1C=CNC=1)=O

Computed Properties

  • Exact Mass: 153.07900
  • Monoisotopic Mass: 153.079
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 4
  • Complexity: 136
  • 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: 53.1A^2
  • XLogP3: 0.8

Experimental Properties

  • Density: 1.194
  • Melting Point: 91-95?°C
  • Boiling Point: 328°Cat760mmHg
  • Flash Point: 152.2°C
  • Refractive Index: 1.553
  • PSA: 53.09000
  • LogP: 1.42200

4-(1H-pyrrol-3-yl)butanoic acid Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H315-H319-H335
  • Warning Statement: P261-P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26; S36/37
  • Hazardous Material Identification: Xi
  • Storage Condition:?20°C
  • Risk Phrases:R36/37/38

4-(1H-pyrrol-3-yl)butanoic acid 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%

4-(1H-pyrrol-3-yl)butanoic acid Pricemore >>

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4-(1H-pyrrol-3-yl)butanoic acid Related Literature

  • 1. Strategies towards functionalised electronically conducting organic copolymers: Part 2. Copolymerisation
    Karl S. Ryder,Lutz F. Schweiger,Andrew Glidle,Jon. M. Cooper J. Mater. Chem. 2000 10 1785
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