CAS No.201354-26-9,H-AAD(OTBU)-OH Suppliers

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Basic Information

Molecular Structure:
CAS No.:	201354-26-9
Name:	H-AAD(OTBU)-OH

Formula:	C₁₀H₁₉NO₄
Molecular Weight:	217.13
Synonyms:	Hexanedioicacid, 2-amino-, 6-(1,1-dimethylethyl) ester, (S)-;
Density:	1.11 g/cm³
Boiling Point:	330.528 °C at 760 mmHg
Flash Point:	153.698 °C
PSA:	89.62000
LogP:	2.41260

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Specification

The L-2-Aminohexanedioicacid-d-t-butyl ester, with the CAS registry number 201354-26-9, is also known as 6-[(2-Methyl-2-propanyl)oxy]-6-oxo-L-norleucine. This chemical's molecular formula is C₁₀H₁₉NO₄ and molecular weight is 217.26. What's more, its IUPAC name is called (2S)-2-Amino-6-[(2-methylpropan-2-yl)oxy]-6-oxohexanoic acid.

Physical properties about L-2-Aminohexanedioicacid-d-t-butyl ester are: (1) ACD/LogP: 1.11; (2) # of Rule of 5 Violations: 0; (3) #H bond acceptors: 5; (4) #H bond donors: 3; (5) #Freely Rotating Bonds: 8; (6) Polar Surface Area: 89.62 Å²; (7) Index of Refraction: 1.475; (8) Molar Refractivity: 55.17 cm³; (9)Molar Volume: 195.8 cm³; (10) Surface Tension: 41.8 dyne/cm; (11) Density: 1.109 g/cm³; (12) Flash Point: 153.7 °C; (13) Enthalpy of Vaporization: 63 kJ/mol; (14) Boiling Point: 330.5 °C at 760 mmHg; (15) Vapour Pressure: 3.23E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: CC(C)(C)OC(=O)CCC[C@H](N)C(O)=O
(2) InChI: InChI=1/C10H19NO4/c1-10(2,3)15-8(12)6-4-5-7(11)9(13)14/h7H,4-6,11H2,1-3H3,(H,13,14)/t7-/m0/s1
(3) InChIKey: WWSDFHPRIJAESZ-ZETCQYMHBS