Product Name

  • Name

    (R)-3-AMINO-4-(3-THIENYL)BUTANOIC ACID HYDROCHLORIDE

  • EINECS
  • CAS No. 269726-91-2
  • Density 1.291
  • Solubility
  • Melting Point
  • Formula C8H12ClNO2S
  • Boiling Point 369oC at 760 mmHg
  • Molecular Weight 185.24
  • Flash Point 176.9oC
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 269726-91-2 ((R)-3-AMINO-4-(3-THIENYL)BUTANOIC ACID HYDROCHLORIDE)
  • Hazard Symbols
  • Synonyms 3-Thiophenebutanoic acid, β-amino-, (βR)-;
  • PSA 91.56000
  • LogP 2.59490

(R)-3-Amino-4-(3-thienyl)butanoic acid Specification

The (R)-3-Amino-4-(3-thienyl)butanoic acid hydrochloride, with the CAS registry number 269726-91-2, is also known as (3R)-3-Amino-4-(3-thienyl)butanoic acid hydrochloride (1:1). It belongs to the product categories of 3-Amino-4-phenylbutanoic Acid Analogs; B-Amino. This chemical's molecular formula is C8H12ClNO2S and molecular weight is 221.7. What's more, its systematic name is 3-Thiophenebutanoic acid, beta-amino-, (betaR)-, hydrochloride (1:1).

Physical properties of (R)-3-Amino-4-(3-thienyl)butanoic acid hydrochloride are: (1)ACD/LogP: 1.01; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 91.56 Å2; (7)Flash Point: 176.9 °C; (8)Enthalpy of Vaporization: 64.95 kJ/mol; (9)Boiling Point: 369 °C at 760 mmHg; (10)Vapour Pressure: 4.28E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.N[C@@H](CC(O)=O)Cc1ccsc1
(2)InChI: InChI=1S/C8H11NO2S.ClH/c9-7(4-8(10)11)3-6-1-2-12-5-6;/h1-2,5,7H,3-4,9H2,(H,10,11);1H/t7-;/m1./s1
(3)InChIKey: QDZZLMYYGBIDFT-OGFXRTJISA-N

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