CAS No.74562-03-1,BOC-(R)-2-THIENYLGLYCINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	74562-03-1
Name:	BOC-(R)-2-THIENYLGLYCINE
Article Data:	6

Formula:	C₁₁H₁₅NO₄S
Molecular Weight:	257.31
Synonyms:	2-Thiopheneaceticacid, a-[[(1,1-dimethylethoxy)carbonyl]amino]-,(R)-;(2R)-[(tert-butoxycarbonyl)amino](thiophen-2-yl)ethanoic acid;
Density:	1.273 g/cm³
Boiling Point:	421.3 °C at 760 mmHg
Flash Point:	208.6 °C
Hazard Symbols:	Xi
PSA:	103.87000
LogP:	2.78940

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Specification

The Boc-(R)-2-thienylglycine with the CAS registry number 74562-03-1, is also known as Boc-L-(2-thienyl)glycine. It belongs to the product category of Unusual Amino Acids. This chemical's molecular formula is C₁₁H₁₅NO₄S and molecular weight is 257.31. What's more, its systematic name is (2R)-[(tert-butoxycarbonyl)amino](thiophen-2-yl)ethanoic acid.

Other characteristics of the Boc-(R)-2-thienylglycine can be summarised as followings: (1)ACD/LogP: 2.42; (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): 1.68; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 5; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 5; (10)Polar Surface Area: 103.87 Å²; (11)Index of Refraction: 1.549; (12)Molar Refractivity: 64.25 cm³; (13)Molar Volume: 201.9 cm³; (14)Polarizability: 25.47×10^-24 cm³; (15)Surface Tension: 48.9 dyne/cm; (16)Density: 1.273 g/cm³; (17)Flash Point: 208.6 °C; (18)Enthalpy of Vaporization: 71.19 kJ/mol; (19)Boiling Point: 421.3 °C at 760 mmHg; (20)Vapour Pressure: 7.53E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: OC(=O)[C@@H](NC(=O)OC(C)(C)C)c1cccs1
2.InChI: InChI=1/C11H15NO4S/c1-11(2,3)16-10(15)12-8(9(13)14)7-5-4-6-17-7/h4-6,8H,1-3H3,(H,12,15)(H,13,14)/t8-/m0/s1
3.InChIKey: CFAJOXPICRIMCA-QMMMGPOBBR