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tert-butyl(2S)-2-[(tert-butoxycarbonyl)amino]-4-oxobutanoate

tert-butyl(2S)-2-[(tert-butoxycarbonyl)amino]-4-oxobutanoate structure

CAS No:
81323-59-3
Formula:
C13H23NO5
Chemical Name:
tert-butyl(2S)-2-[(tert-butoxycarbonyl)amino]-4-oxobutanoate
Synonyms:
tert-butyl (2S)-2-[(tert-butoxycarbonyl)amino]-4-oxobutanoate;butanoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-4-oxo-, 1,1-dimethylethyl ester, (2S)-;187445;(S)-tert-butyl 2-((tert-butoxycarbonyl)amino)-4-oxobutanoate

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tert-butyl(2S)-2-[(tert-butoxycarbonyl)amino]-4-oxobutanoate Basic Attributes

Molecular Weight：

273.33

Exact Mass：

273.15762283

Characteristics

PSA：

81.70000

XLogP3：

2.20130

Density：

1.064±0.06 g/cm3

Melting Point：

60-62 °C

Boiling Point：

381.0±37.0 °C(Predicted)

PKA：

10.70±0.46

Computed Properties

Molecular Weight:273.33
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:273.15762283
Monoisotopic Mass:273.15762283
Topological Polar Surface Area:81.7
Heavy Atom Count:19
Complexity:338
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of tert-butyl(2S)-2-[(tert-butoxycarbonyl)amino]-4-oxobutanoate

Basic Attributes
Characteristics
Computed Properties

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