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Aspartic acid β-methyl ester

Aspartic acid β-methyl ester structure

CAS No:
2177-62-0
Formula:
C5H9NO4
Chemical Name:
Aspartic acid β-methyl ester
Synonyms:
L-Aspartic acid,4-methyl ester;Aspartic acid,4-methyl ester,L-;Aspartic acid β-methyl ester;L-Aspartic acid β-methyl ester;β-L-Aspartyl methyl ester;β-Methyl aspartate;(S)-2-Aminobutanedioic acid 4-methyl ester;4-Methyl L-aspartate;β-Methyl L-aspartate;(S)-2-Amino-4-methoxy-4-oxobutanoic acid;7481-56-3
Categories:
Biochemical Engineering > Amino Acids and Derivatives

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Aspartic acid β-methyl ester Basic Attributes

Molecular Weight：

148.14

Exact Mass：

147.13

EC Number：

218-540-2

HScode：

2922509090

Characteristics

PSA：

100.62000

XLogP3：

-0.29

Density：

1.3±0.1 g/cm3

Melting Point：

193-195 °C

Boiling Point：

301.7±37.0 °C at 760 mmHg

Flash Point：

136.3±26.5 °C

Refractive Index：

1.478

Drug Information

MeSH Entry Terms：

aspartic acid 4-methyl ester

Computed Properties

Molecular Weight:147.13
XLogP3:-2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:147.05315777
Monoisotopic Mass:147.05315777
Topological Polar Surface Area:89.6
Heavy Atom Count:10
Complexity:145
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 2177-62-0

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4-Methyl hydrogen L-aspartate

CAS No.: 2177-62-0

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Guide of Aspartic acid β-methyl ester

Basic Attributes
Characteristics
Drug Information
Computed Properties
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Aspartic acid β-methyl ester

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