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Boc-(R)-3-Amino-4-(1-naphthyl)butyric acid

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Name

Boc-(R)-3-Amino-4-(1-naphthyl)butyric acid

EINECS N/A
CAS No. 190190-49-9 Density 1.179 g/cm3
PSA 75.63000 LogP 4.14120
Solubility N/A Melting Point N/A
Formula C19H23NO4 Boiling Point 527.932 °C at 760 mmHg
Molecular Weight 329.39 Flash Point 273.084 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 190190-49-9 (BOC-(R)-3-AMINO-4-(1-NAPHTHYL)-BUTYRIC ACID) Hazard Symbols N/A
Synonyms

1-Naphthalenebutanoicacid, b-[[(1,1-dimethylethoxy)carbonyl]amino]-,(R)- (9CI);(3R)-3-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-4-(1-naphthyl)butanoic acid;

 

Boc-(R)-3-Amino-4-(1-naphthyl)butyric acid Specification

The 1-Naphthalenebutanoicacid, beta-[[(1,1-dimethylethoxy)carbonyl]amino]-,(betaR)-, with the CAS registry number 190190-49-9, is also known as Boc-(R)-3-Amino-4-(1-naphthyl)-butyric acid. It belongs to the product categories of 3-Amino-4-phenylbutyric Acid Analogs; 3-Amino-4-phenylbutanoic Acid Analogs; B-Amino. This chemical's molecular formula is C19H23NO4 and molecular weight is 329.39. Its systematic name is called (3R)-3-[(tert-butoxycarbonyl)amino]-4-naphthalen-1-ylbutanoic acid.

Physical properties of 1-Naphthalenebutanoicacid, beta-[[(1,1-dimethylethoxy)carbonyl]amino]-,(betaR)-: (1)ACD/LogP: 4.41; (2)ACD/LogD (pH 5.5): 3.15; (3)ACD/LogD (pH 7.4): 1.37; (4)ACD/BCF (pH 5.5): 73.46; (5)ACD/BCF (pH 7.4): 1.21; (6)ACD/KOC (pH 5.5): 331.34; (7)ACD/KOC (pH 7.4): 5.46; (8)#H bond acceptors: 5; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 7; (11)Index of Refraction: 1.579; (12)Molar Refractivity: 92.93 cm3; (13)Molar Volume: 279.2 cm3; (14)Surface Tension: 47.5 dyne/cm; (15)Density: 1.179 g/cm3; (16)Flash Point: 273.1 °C; (17)Enthalpy of Vaporization: 84.49 kJ/mol; (18)Boiling Point: 527.9 °C at 760 mmHg; (19)Vapour Pressure: 5.65E-12 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](CC(=O)O)Cc2cccc1ccccc12
(2)InChI: InChI=1/C19H23NO4/c1-19(2,3)24-18(23)20-15(12-17(21)22)11-14-9-6-8-13-7-4-5-10-16(13)14/h4-10,15H,11-12H2,1-3H3,(H,20,23)(H,21,22)/t15-/m1/s1
(3)InChIKey: JXDXPRAUFACOHG-OAHLLOKOBJ

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