Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

b-Alanine,N-[(3-fluorophenyl)sulfonyl]-

Related Products

Hot Products

Basic Information Post buying leads Suppliers
Name

b-Alanine,N-[(3-fluorophenyl)sulfonyl]-

EINECS N/A
CAS No. 690646-10-7 Density 1.438 g/cm3
PSA 91.85000 LogP 2.05040
Solubility N/A Melting Point N/A
Formula C9H10FNO4S Boiling Point 441.8 °C at 760 mmHg
Molecular Weight 247.247 Flash Point 221 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 690646-10-7 (3-([(3-FLUOROPHENYL)SULFONYL]AMINO)PROPANOIC ACID) Hazard Symbols N/A
Synonyms

N-[(3-Fluorophenyl)sulfonyl]-β-alanine;3-{[(3-Fluorophenyl)sulfonyl]amino}propanoic acid;

 

b-Alanine,N-[(3-fluorophenyl)sulfonyl]- Specification

The b-Alanine,N-[(3-fluorophenyl)sulfonyl]-, with the CAS registry number 690646-10-7, is also known as 3-{[(3-Fluorophenyl)sulfonyl]amino}propanoic acid. This chemical's molecular formula is C9H10FNO4S and molecular weight is 247.2434. What's more, its systematic name is N-[(3-Fluorophenyl)sulfonyl]-β-alanine.

Physical properties about the b-Alanine,N-[(3-fluorophenyl)sulfonyl]- are: (1) ACD/LogP: 1.20; (2) # of Rule of 5 Violations: 0; (3) ACD/BCF (pH 5.5): 1; (4) ACD/BCF (pH 7.4): 1; (5) ACD/KOC (pH 5.5): 3.84; (6) ACD/KOC (pH 7.4): 1; (7) #H bond acceptors: 5; (8) #H bond donors: 2; (9) #Freely Rotating Bonds: 4; (10) Polar Surface Area: 72.06 Å2; (11) Index of Refraction: 1.551; (12) Molar Refractivity: 54.87 cm3; (13) Molar Volume: 171.8 cm3; (14) Polarizability: 21.75×10-24 cm3; (15) Surface Tension: 51.8 dyne/cm; (16) Density: 1.438 g/cm3; (17) Flash Point: 221 °C; (18) Enthalpy of Vaporization: 73.69 kJ/mol; (19) Boiling Point: 441.8 °C at 760 mmHg; (20) Vapour Pressure: 1.39E-08 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=S(=O)(c1cc(F)ccc1)NCCC(=O)O
(2) InChI: InChI=1/C9H10FNO4S/c10-7-2-1-3-8(6-7)16(14,15)11-5-4-9(12)13/h1-3,6,11H,4-5H2,(H,12,13)
(3) InChIKey: VJNJTPCJMBPYFS-UHFFFAOYAN

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 690646-10-7