(R)-3-(Boc-amino)-2-methylpropionic acid supplier

Name
(R)-3-(BOC-AMINO)-2-METHYLPROPIONIC ACID
EINECS
CAS No. 132696-45-8
Article Data16
CAS DataBase
Density 1.102 g/cm³
Solubility
Melting Point 88 °C(lit.)
Formula C₉H₁₇NO₄
Boiling Point 339.502 °C at 760 mmHg
Molecular Weight 203.238
Flash Point 159.125 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (R)-3-[(tert-Butoxy)carbonyl]amino-2-methylpropanoic acid;Propanoicacid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-, (R)-;(2R)-3-(tert-Butoxycarbonylamino)-2-methylpropionicacid;
PSA 75.63000
LogP 1.62270

(R)-3-(Boc-amino)-2-methylpropionic acid Specification

This chemical is called Boc-R-3-Aminoisobutyric acid, and its systematic name is (2R)-3-[(tert-butoxycarbonyl)amino]-2-methylpropanoic acid. With the molecular formula of C₉H₁₇NO₄, its product category is N-BOC. The CAS registry number of this chemical is 132696-45-8. Additionally, it should be stored at 2-8°C.

Other characteristics of the Boc-R-3-Aminoisobutyric acid can be summarised as followings: (1)ACD/LogP: 1.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): -2; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 7; (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: 75.63 Å²; (13)Index of Refraction: 1.461; (14)Molar Refractivity: 50.603 cm³; (15)Molar Volume: 184.445 cm³; (16)Polarizability: 20.061×10^-24cm³; (17)Surface Tension: 37.747 dyne/cm; (18)Density: 1.102 g/cm³; (19)Flash Point: 159.125 °C; (20)Enthalpy of Vaporization: 64.067 kJ/mol; (21)Boiling Point: 339.502 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OC(C)(C)C)NC[C@H](C(=O)O)C
2.InChI: InChI=1/C9H17NO4/c1-6(7(11)12)5-10-8(13)14-9(2,3)4/h6H,5H2,1-4H3,(H,10,13)(H,11,12)/t6-/m1/s1
3.InChIKey: GDQRNRYMFXDGMS-ZCFIWIBFBJ

Product Name

(R)-3-(BOC-AMINO)-2-METHYLPROPIONIC ACID

(R)-3-(Boc-amino)-2-methylpropionic acid Specification

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