CAS No.109183-72-4,Boc-L-Cyclopentylglycine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	109183-72-4
Name:	Boc-L-Cyclopentylglycine
Article Data:	2

Formula:	C₁₂H₂₁NO₄
Molecular Weight:	243.303
Synonyms:	(2S)-[(tert-Butoxycarbonyl)amino](cyclopentyl)acetic acid;(2S)-[(tert-Butoxycarbonyl)amino](cyclopentyl)ethanoic acid;(2S)-Cyclopentyl({[(2-methyl-2-propanyl)oxy]carbonyl}amino)acetic acid;TL8000295;
Density:	1.137 g/cm³
Boiling Point:	393.5 °C at 760 mmHg
Flash Point:	191.8 °C
PSA:	75.63000
LogP:	2.54540

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Specification

The Cyclopentaneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-, (alphaS)-, with the CAS registry number 109183-72-4, is also known as Boc-L-Cyclopentylglycine. It belongs to the product categories of Amino Acid Derivatives; Peptide; A-amino. This chemical's molecular formula is C₁₂H₂₁NO₄ and molecular weight is 243.3. What's more, its IUPAC name is (2S)-2-cyclopentyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid. Its storage temperature is -15°C.

Physical properties of Cyclopentaneacetic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-, (alphaS)- are: (1)ACD/LogP: 2.60; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.72; (4)ACD/LogD (pH 7.4): -0.86; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 8.27; (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: 55.84 Å²; (13)Index of Refraction: 1.494; (14)Molar Refractivity: 62.35 cm³; (15)Molar Volume: 213.8 cm³; (16)Surface Tension: 43.5 dyne/cm; (17)Density: 1.137 g/cm³; (18)Flash Point: 191.8 °C; (19)Enthalpy of Vaporization: 70.62 kJ/mol; (20)Boiling Point: 393.5 °C at 760 mmHg; (21)Vapour Pressure: 2.74E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)(C)OC(=O)NC(C1CCCC1)C(=O)O
(2)Isomeric SMILES: CC(C)(C)OC(=O)N[C@@H](C1CCCC1)C(=O)O
(3)InChI: InChI=1S/C12H21NO4/c1-12(2,3)17-11(16)13-9(10(14)15)8-6-4-5-7-8/h8-9H,4-7H2,1-3H3,(H,13,16)(H,14,15)/t9-/m0/s1
(4)InChIKey: WBSJQVRMQOLSAT-VIFPVBQESA-N