Boc-(R)-3-Thienylglycine supplier

Name
BOC-(R)-3-THIENYLGLYCINE
EINECS
CAS No. 33130-97-1
Density 1.273 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₅NO₄S
Boiling Point 425.2 °C at 760 mmHg
Molecular Weight 257.31
Flash Point 210.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Thiopheneaceticacid, α-(carboxyamino)-, α-tert-butyl ester, D-(-)- (8CI);3-Thiopheneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-, (R)- (9CI);(R)-(tert-Butoxycarbonylamino)thiophen-3-ylethanoic acid;(2R)-[(tert-Butoxycarbonyl)amino](thiophen-3-yl)ethanoic acid;
PSA 103.87000
LogP 2.78940

Boc-(R)-3-Thienylglycine Specification

The Boc-(R)-3-Thienylglycine, with the CAS registry number 33130-97-1, is also known as 3-thiopheneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-, (αR)-. 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-3-yl)ethanoic acid.

Physical properties of 3-Thiopheneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-, (αR)- are: (1)ACD/LogP: 2.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.03; (4)ACD/LogD (pH 7.4): -1.23; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.75; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 84.08 Å²; (13)Index of Refraction: 1.549; (14)Molar Refractivity: 64.25 cm³; (15)Molar Volume: 201.9 cm³; (16)Polarizability: 25.47×10^-24cm³; (17)Surface Tension: 48.9 dyne/cm; (18)Density: 1.273 g/cm³; (19)Flash Point: 210.9 °C; (20)Enthalpy of Vaporization: 71.66 kJ/mol; (21)Boiling Point: 425.2 °C at 760 mmHg; (22)Vapour Pressure: 5.49E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OC(C)(C)C)N[C@H](c1ccsc1)C(=O)O
2.InChI: InChI=1/C11H15NO4S/c1-11(2,3)16-10(15)12-8(9(13)14)7-4-5-17-6-7/h4-6,8H,1-3H3,(H,12,15)(H,13,14)/t8-/m1/s
3.InChIKey: VJYLMXXKPBZDHN-MRVPVSSYBZ

Product Name

BOC-(R)-3-THIENYLGLYCINE

Boc-(R)-3-Thienylglycine Specification

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