BOC-D-NVA-OH
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BOC-D-NVA-OH
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CAS No:
57521-85-4
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Formula:
C10H19NO4
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Chemical Name:
BOC-D-NVA-OH
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Synonyms:
BOC-D-NHCH[CH3(CH2)]-COOH;BOC-D-NORVALINE;N-ALPHA-T-BUTOXYCARBONYL-D-2-AMINO-PENTANOIC ACID;N-ALPHA-T-BUTOXYCARBONYL-D-NORVALINE;N-ALPHA-T-BOC-D-NORVALINE;(R)-2-(BOC-AMINO)PENTANOIC ACID;RARECHEM EM WB 0169;Cbz-D-Norvaline
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CAS No:
Characteristics
75.6
1.8
White Powder
1.1±0.1 g/cm3
348.3°C at 760 mmHg
164.4±23.2 °C
1.462
Store at RT.
Safety Information
III
IRRITANT
UN 3261 8/PG 2
3
R14:Reacts violently with water. R35:Causes severe burns.
S26-S36/37/39-S45
C
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
BOC-D-NVA-OH Use and Manufacturing
(R)-2-((tert-butoxycarbonyl)amino)pentanoic acid (DiOl)HONAOTo a mixture of (R)-2-aminopentanoic acid (2.343 g) and Na2CO3 (2.120 g) in water (60.00 mL) was added dropwise a solution of Boc2O (4.88 mL) in THF (20 mL). The mixture was stirred at RT overnight. The mixture was washed with ether (2x20 mL), and the water phase was adjusted to pH = 3 with K}{S04 solution and then extracted with EtOAc (2x30 mL). The combined organic was dried and evaporated to afford the title compound (4 g) as sticky oil. MS (ESI): C10H19N04 requires217; found 216 [M..H].
Computed Properties
Molecular Weight:217.26
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:217.13140809
Monoisotopic Mass:217.13140809
Topological Polar Surface Area:75.6
Heavy Atom Count:15
Complexity:232
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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