Welcome to LookChem.com Sign In|Join Free

Product Name

  • or
Home > Products > 

1H-Indole-3-butanoicacid, β-amino-, (βS)-

Basic Information Post buying leads Suppliers
  • Name 1H-Indole-3-butanoicacid, β-amino-, (βS)-
  • EINECSN/A
  • CAS No. 192003-01-3
  • Density1.311 g/cm3
  • PSA79.11000
  • LogP3.01470
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC12H14N2O2
  • Boiling Point462.3 °C at 760 mmHg
  • Molecular Weight218.2518
  • Flash Point233.4 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 192003-01-3 (L-BETA-HOMOTRYPTOPHAN HYDROCHLORIDE)
  • Hazard SymbolsN/A
  • SynonymsN/A

1H-Indole-3-butanoicacid, β-amino-, (βS)- Specification

The 1H-Indole-3-butanoicacid, β-amino-, (βS)-, with the CAS registry number 192003-01-3, is also known as 1H-Indole-3-butanoicacid, β-amino-, (S)-. It belongs to the product categories of β-Homo Amino Acids and Beta Amino Acids. This chemical's molecular formula is C12H14N2O2 and molecular weight is 218.2518. What's more, its systematic name and its IUPAC name are the same which is called (3S)-3-Amino-4-(1H-indol-3-yl)butanoic acid.

Physical properties about 1H-Indole-3-butanoicacid, β-amino-, (βS)-: (1)ACD/LogP: 1.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.25; (4)ACD/LogD (pH 7.4): -1.25; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 34.47 Å2; (13)Index of Refraction: 1.673; (14)Molar Refractivity: 62.4 cm3; (15)Molar Volume: 166.3 cm3; (16)Surface Tension: 66.4 dyne/cm; (17)Density: 1.311 g/cm3; (18)Flash Point: 233.4 °C; (19)Enthalpy of Vaporization: 76.21 kJ/mol ; (20)Boiling Point: 462.3 °C at 760 mmHg; (21)Vapour Pressure: 2.42E-09 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)C[C@@H](N)Cc2c1ccccc1nc2
(2) InChI: InChI=1/C12H14N2O2/c13-9(6-12(15)16)5-8-7-14-11-4-2-1-3-10(8)11/h1-4,7,9,14H,5-6,13H2,(H,15,16)/t9-/m0/s1
(3) InChIKey: DUVVFMLAHWNDJD-VIFPVBQEBP

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 192003-01-3
Related Products

Hot Products

Post a RFQ