(R)-3-amino-4-(2-thienyl)-butyric acid-HCl supplier

Name
(S)-3-AMINO-4-(2-THIENYL)BUTANOIC ACID HYDROCHLORIDE
EINECS
CAS No. 269726-88-7
Density 1.291
Solubility
Melting Point
Formula C₈H₁₂ClNO₂S
Boiling Point 336.9 °C at 760 mmHg
Molecular Weight 221.7
Flash Point 157.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (3S)-3-Amino-4-(2-thienyl)butanoic acid hydrochloride;(3S)-3-Amino-4-(2-thienyl)butanoic acid hydrochloride (1:1);(3S)-3-Amino-4-(thiophen-2-yl)butanoic acid hydrochloride;(S)-3-Amino-4-(2-thienyl)butanoic acid hydrochloride;(S)-3-Amino-4-(2-thienyl)-butyric acid-HCl;TL8002152;
PSA 91.56000
LogP 2.59490

(R)-3-amino-4-(2-thienyl)-butyric acid-HCl Specification

The 2-Thiophenebutanoic acid, β-amino-, (betaS)-, hydrochloride (1:1), with the CAS registry number 269726-90-1, is also known as (S)-3-Amino-4-(2-thienyl)-butyric acid-HCl. It belongs to the product category of B-Amino. This chemical's molecular formula is C₈H₁₂ClNO₂S and molecular weight is 221.7. What's more, its systematic name is (3S)-3-amino-4-thiophen-2-ylbutanoic acid hydrochloride.

Physical properties of 2-Thiophenebutanoic acid, β-amino-, (betaS)-, hydrochloride (1:1) are: (1)ACD/LogP: 1.01; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.49; (4)ACD/BCF (pH 5.5): 1; (5)ACD/KOC (pH 5.5): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 5; (9)Polar Surface Area: 57.78 Å²; (10)Flash Point: 157.5 °C; (11)Enthalpy of Vaporization: 61.22 kJ/mol; (12)Boiling Point: 336.9 °C at 760 mmHg; (13)Vapour Pressure: 4.27E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O=C(O)C[C@H](N)Cc1sccc1
(2)InChI: InChI=1S/C8H11NO2S.ClH/c9-6(5-8(10)11)4-7-2-1-3-12-7;/h1-3,6H,4-5,9H2,(H,10,11);1H/t6-;/m1./s1
(3)InChIKey: DPMHHGFSWLCCBH-FYZOBXCZSA-N

Product Name

(S)-3-AMINO-4-(2-THIENYL)BUTANOIC ACID HYDROCHLORIDE

(R)-3-amino-4-(2-thienyl)-butyric acid-HCl Specification

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