4-Methyl hydrogen aspartate
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4-Methyl hydrogen aspartate
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CAS No:
1835-51-4
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Formula:
C5H9NO4
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Chemical Name:
4-Methyl hydrogen aspartate
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Synonyms:
Aspartic acid,4-methyl ester;4-Methyl hydrogen aspartate;DL-Aspartic acid β-methyl ester;(RS)-2-amino-3-methoxycarbonylpropionic acid;2-Amino-4-methoxy-4-oxobutanoic acid;2-Amino-succinic acid 4-methyl ester
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CAS No:
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, 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.
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
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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