Cas no 100393-41-7 (3-Amino-3-(1-naphthyl)propanoic Acid)

3-Amino-3-(1-naphthyl)propanoic Acid structure
100393-41-7 structure
Product Name:3-Amino-3-(1-naphthyl)propanoic Acid
CAS No:100393-41-7
MF:C13H13NO2
MW:215.247823476791
MDL:MFCD00269725
CID:200440
PubChem ID:2764540
Update Time:2024-11-04

3-Amino-3-(1-naphthyl)propanoic Acid Chemical and Physical Properties

Names and Identifiers

    • 1-Naphthalenepropanoicacid, b-amino-
    • 3-Amino-3-(1-naphthyl)propanoic acid
    • 3-Amino-3-naphthalen-1-yl-propionic acid
    • 3-amino-3-(1-naphthyl)propanoic acid(SALTDATA: FREE)
    • 3-amino-3-(1-naphthyl)propionic acid
    • 3-amino-3-(naphthalen-1-yl)propanoic acid
    • 3-amino-3-[1]naphthyl-propionic acid
    • 3-Amino-3-[1]naphthyl-propions
    • 3-amino-3-naphthylpropanoic acid
    • ACMC-1BLA7
    • aminonaphthylpropanoicacid
    • CBDivE_003465
    • rac-3-amino-3-(1-naphthyl)propanoic acid
    • DTXSID80377489
    • MFCD00269725
    • AB05537
    • 3-AMINO-3-NAPHTHALEN-1-YL-PROPIONICACID
    • EN300-297348
    • 1-Naphthalenepropanoic acid, -amino-
    • 3-amino-3-(naphthalen-1-yl)propanoicacid
    • FT-0680744
    • 9R-0635
    • AKOS016045551
    • AB17701
    • CS-0034118
    • AKOS000182210
    • SCHEMBL1520324
    • STK731591
    • BBL012153
    • BB 0249714
    • 3-amino-3-(1-naph-thyl)propanoic acid
    • AB17766
    • N12161
    • 3-amino-3-naphthalen-1-ylpropanoic acid
    • 1-Naphthalenepropanoic acid, beta-amino-
    • 100393-41-7
    • J-511581
    • DB-058426
    • (s)-3-amino-3-(1-naphthyl)propanoic acid
    • (S)-3-Amino-3-(1-naphthylphenyl)-propionic acid
    • SY227083
    • SY256013
    • MFCD04113670
    • (R)-3-Amino-3-(1-naphthyl)propionic acid
    • (S)-3-Amino-3-(1-naphthyl)propionic acid
    • (R)-3-Amino-3-(1-naphthylphenyl)-propionic acid
    • 3-Amino-3-(1-naphthyl)propanoic Acid
    • MDL: MFCD00269725
    • Inchi: 1S/C13H13NO2/c14-12(8-13(15)16)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12H,8,14H2,(H,15,16)
    • InChI Key: BIOQBKBTOAMMDG-UHFFFAOYSA-N
    • SMILES: OC(CC(C1C=CC=C2C=CC=CC=12)N)=O

Computed Properties

  • Exact Mass: 215.09469
  • Monoisotopic Mass: 215.094629
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 249
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 67.8
  • XLogP3: -0.7

Experimental Properties

  • Density: 1.252
  • Melting Point: 217-219°C
  • Boiling Point: 412.3°Cat760mmHg
  • Flash Point: 203.2°C
  • Refractive Index: 1.658
  • PSA: 63.32
  • LogP: 3.01460

3-Amino-3-(1-naphthyl)propanoic Acid Security Information

  • Hazard Category Code: 22
  • Hazardous Material Identification: Xn
  • HazardClass:IRRITANT

3-Amino-3-(1-naphthyl)propanoic Acid Pricemore >>

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