Cas no 781-74-8 (4-(naphthalen-1-yl)butanoic acid)

4-(naphthalen-1-yl)butanoic acid structure
781-74-8 structure
Product Name:4-(naphthalen-1-yl)butanoic acid
CAS No:781-74-8
MF:C14H14O2
MW:214.259764194489
CID:1790956
PubChem ID:13077
Update Time:2025-04-21

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

Names and Identifiers

    • 4-(naphthalen-1-yl)butanoic acid
    • 4-naphthalen-1-ylbutanoic acid
    • 4-(1-naphthyl)butanoic acid
    • 4-Naphthalen-1-yl-butyric acid
    • GAMMA-(1-NAPHTHYL)BUTYRIC ACID
    • NSC 3046
    • 4-(1-naphthyl) butyric acid
    • AKOS013528140
    • EN300-1839958
    • NSC3046
    • CS-0270334
    • 1-Naphthalenebutanoic acid
    • SCHEMBL2314388
    • DTXSID70228734
    • 1-Naphthalenebutyric acid
    • NSC-3046
    • 781-74-8
    • LZVCOUNJXYIOQA-UHFFFAOYSA-N
    • DS-003125
    • Inchi: 1S/C14H14O2/c15-14(16)10-4-8-12-7-3-6-11-5-1-2-9-13(11)12/h1-3,5-7,9H,4,8,10H2,(H,15,16)
    • InChI Key: LZVCOUNJXYIOQA-UHFFFAOYSA-N
    • SMILES: OC(CCCC1C=CC=C2C=CC=CC=12)=O

Computed Properties

  • Exact Mass: 214.09942
  • Monoisotopic Mass: 214.099379685g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 237
  • 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: 3.7
  • Topological Polar Surface Area: 37.3?2

Experimental Properties

  • PSA: 37.3

4-(naphthalen-1-yl)butanoic acid Pricemore >>

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